SCHEMBL916597

SCHEMBL916597

O=C1C(=Nc2ccc(C(F)(F)F)cc2)c2ccccc2N1c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 15/20 0.76
HTR4 Q13639 1/20 0.76
MAPT P10636 3/20 0.50
DRD5 P21918 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ADRA1A P35348 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
TTR P02766 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.48

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
SCHEMBL916590 1.00 GALR3 (0.76) GALR3HTR4MAPTDRD5NPSR1
SCHEMBL8273654 0.90 GALR3 (0.63) GALR3HTR4DRD5ADRA1ATTR
SCHEMBL6905291 0.90 GALR3 (0.65) GALR3HTR4MAPTDRD5NPSR1
SCHEMBL8171053 0.90 GALR3 (0.65) GALR3HTR4MAPTDRD5NPSR1
SCHEMBL916991 0.86 GALR3 (1.00) GALR3HTR4DRD5ADRA1A
SCHEMBL916990 0.86 GALR3 (1.00) GALR3HTR4DRD5ADRA1A
SCHEMBL8273294 0.86 GALR3 (1.00) GALR3HTR4DRD5ADRA1A
SCHEMBL918243 0.86 GALR3 (0.78) GALR3HTR4DRD5ADRA1A
SCHEMBL918241 0.86 GALR3 (0.78) GALR3HTR4DRD5ADRA1A
SCHEMBL917699 0.85 GALR3 (0.62) GALR3HTR4MAPTNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-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
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-20070259942-A1 Use of GAL3 antagonist for treatment of depression and/or anxiety and compounds useful in such methods BLACKBURN THOMAS P 2007-11-08 US disclosed
US-20070135509-A1 Indolone compounds useful to treat cognitive impairment BLACKBURN THOMAS P 2007-06-14 US disclosed
US-20070135510-A1 Indolone Compounds Useful To Treat Cognitive Impairment DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2007-06-14 US disclosed
US-7220775-B2 Compound useful for the treatment of neuropathic pain H. LUNDBECK A/S (DK) 2007-05-22 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
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
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-20100179187-A1 INDOLONE COMPOUNDS USEFUL TO TREAT COGNITIVE IMPAIRMENT CHAT, AANAT, TPH2 GALR3 450/4885HTR4 12/4885MAPT 100/4885
US-20070135509-A1 Indolone compounds useful to treat cognitive impairment CHAT, AANAT, TPH2 GALR3 450/4885HTR4 12/4885MAPT 100/4885
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 GALR3 1/4885HTR4 30/4885MAPT 3040/4885
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 GALR3 1/4885HTR4 17/4885MAPT 1723/4885
US-20040127502-A1 Use of GAL3 antagonist for treatment of depression GALR3, GALR2, GALR1 GALR3 1/4885HTR4 24/4885MAPT 3133/4885
US-20040092570-A1 GAL3 antagonists for the treatment of neuropathic pain GALR3, GALR2, GALR1 GALR3 1/4885HTR4 214/4885MAPT 3177/4885
US-20070135510-A1 Indolone Compounds Useful To Treat Cognitive Impairment CHAT, AANAT, TPH2 GALR3 450/4885HTR4 12/4885MAPT 100/4885
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 GALR3 1/4885HTR4 30/4885MAPT 2912/4885
US-20070259942-A1 Use of GAL3 antagonist for treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR2, GALR1 GALR3 1/4885HTR4 32/4885MAPT 2990/4885

“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.