SCHEMBL915633

SCHEMBL915633

O=C1C(=O)N(c2ccsc2)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES1 P23141 10/20 0.64
BCHE P06276 3/20 0.64
ALDH1A1 P00352 3/20 0.64
CES2 O00748 1/20 0.64
GAA P10253 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
TTR P02766 1/20 0.49
TGM2 P21980 1/20 0.43
AOC3 Q16853 2/20 0.40
ALDH2 P05091 2/20 0.39
ALDH3A1 P30838 2/20 0.39
CHRM1 P11229 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CASP3 P42574 1/20 0.38
PARK7 Q99497 1/20 0.37
PTPRC P08575 1/20 0.37
ACHE P22303 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8314729 0.84 CES1 (0.44) CES1BCHEALDH1A1CES2GAA
SCHEMBL8980795 0.80 KMT2A (0.50) GAA
Phenyl Isatin SCHEMBL916808 0.78 CES1 (1.00) CES1BCHEALDH1A1CES2GAA
SCHEMBL7671087 0.78 MAPT (0.56) CES1BCHEALDH1A1CES2GAA
SCHEMBL7671094 0.78 MAPT (0.56) CES1BCHEALDH1A1CES2GAA
SCHEMBL14830555 0.76 CES1 (0.73) CES1BCHEALDH1A1CES2GAA
SCHEMBL918427 0.75 TTR (0.47) CES1BCHEALDH1A1CES2GAA
SCHEMBL918425 0.75 TTR (0.47) CES1BCHEALDH1A1CES2GAA
SCHEMBL915899 0.74 TTR (0.62) NPSR1TTR
SCHEMBL918057 0.74 TTR (0.46) CES1BCHEALDH1A1CES2GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198313-B2 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (DK) 2012-06-12 US disclosed
US-20110178125-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS KONKEL MICHAEL 2011-07-21 US disclosed
US-7868034-B2 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (DK) 2011-01-11 US disclosed
EP-2241316-A1 Indolone compounds useful to treat cognitive impairment Helicon Therapeutics, Inc. (US) 2010-10-20 EP disclosed
EP-1957067-B1 INDOLONE COMPOUNDS USEFUL TO TREAT COGNITIVE IMPAIRMENT HELICON THERAPEUTICS INC (US) 2010-09-08 EP disclosed
US-20100179187-A1 INDOLONE COMPOUNDS USEFUL TO TREAT COGNITIVE IMPAIRMENT DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2010-07-15 US disclosed
EP-2140864-A2 Use of GAL3 receptor antagonists for the treatment of depression and / or anxiety and compounds useful in such methods H.Lundbeck A/S (DK) 2010-01-06 EP disclosed
EP-2140862-A2 Use of GAL 3 receptor antagonists for the treatment of depression and /or anxiety and compounds useful in such methods H.Lundbeck A/S (DK) 2010-01-06 EP disclosed
US-7642281-B2 Indolone compounds useful to treat cognitive impairment HELICON THERAPEUTICS, INC. (US) 2010-01-05 US disclosed
US-20090318504-A1 Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods BLACKBURN THOMAS P 2009-12-24 US disclosed
US-20070054910-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods KONKEL MICHAEL 2007-03-08 US disclosed
US-7081470-B2 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S 2006-07-25 US disclosed
WO-2004093789-A2 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2004-11-04 WO disclosed
US-20040127502-A1 Use of GAL3 antagonist for treatment of depression SYNAPTIC PHARMACEUTICAL CORPORATION 2004-07-01 US disclosed
US-20040110821-A1 administering to the subject suffering from affective disorder a 3-IMINO-1,3-DIHYDRO-2H-INDOL-2-ONE derivative H. LUNDBECK A/S (DK) 2004-06-10 US disclosed
US-20040102507-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (DK) 2004-05-27 US disclosed
US-20040092570-A1 GAL3 antagonists for the treatment of neuropathic pain DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2004-05-13 US disclosed
WO-2004014307-A2 GAL3 ANTAGONISTS FOR THE TREATMENT OF NEUROPATHIC PAIN SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2004-02-19 WO disclosed
WO-2004014376-A1 GAL3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF AFFECTIVE DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2004-02-19 WO disclosed
US-20030078271-A1 Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods SYNAPTIC PHARMACEUTICAL CORPORATION 2003-04-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090318504-A1 Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR2, GALR1 CES1 3810/4885BCHE 3708/4885ALDH1A1 1921/4885
US-20100179187-A1 INDOLONE COMPOUNDS USEFUL TO TREAT COGNITIVE IMPAIRMENT CHAT, AANAT, TPH2 CES1 736/4885BCHE 16/4885ALDH1A1 2040/4885
US-20030078271-A1 Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR2, GALR1 CES1 3810/4885BCHE 3708/4885ALDH1A1 1921/4885
US-20110178125-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS GALR3, GALR1, GALR2 CES1 3787/4885BCHE 3327/4885ALDH1A1 2577/4885
US-20040110821-A1 administering to the subject suffering from affective disorder a 3-IMINO-1,3-DIHYDRO-2H-INDOL-2-ONE derivative GALR3, GALR2, GALR1 CES1 3409/4885BCHE 3586/4885ALDH1A1 1194/4885
US-20040127502-A1 Use of GAL3 antagonist for treatment of depression GALR3, GALR2, GALR1 CES1 3506/4885BCHE 3200/4885ALDH1A1 2098/4885
US-20040092570-A1 GAL3 antagonists for the treatment of neuropathic pain GALR3, GALR2, GALR1 CES1 3892/4885BCHE 2424/4885ALDH1A1 3303/4885
US-20070054910-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR1, GALR2 CES1 3787/4885BCHE 3327/4885ALDH1A1 2577/4885
US-20040102507-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR1, GALR2 CES1 3787/4885BCHE 3327/4885ALDH1A1 2577/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.