SCHEMBL3246500

SCHEMBL3246500

CC(Cc1c[nH]c2ccccc12)Nc1nc(Cl)cc(N2CCCCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 11/20 0.44
NR3C2 P08235 4/20 0.43
PGR P06401 3/20 0.43
KDR P35968 1/20 0.42
SNCA P37840 1/20 0.42
ADRB3 P13945 5/20 0.42
ADRB1 P08588 4/20 0.42
ADRB2 P07550 3/20 0.42
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL4410025 0.83 NR3C1 (0.43) NR3C1NR3C2PGRKDRSNCA
SCHEMBL3244098 0.72 HTR1A (0.46) LMNAHTTKDM4EMAPK1
SCHEMBL9213064 0.69 HTR3E (0.45) NR3C1NR3C2PGRADRB1LMNA
SCHEMBL7646617 0.68 KDM4E (0.58) ADRB1LMNAHTTKDM4EMAPK1
SCHEMBL3263617 0.68 NR3C1 (0.40) NR3C1KDRSNCALMNAHTT
SCHEMBL5174062 0.67 HTR6 (0.59) ADRB1LMNAHTTKDM4EMAPK1
SCHEMBL3243542 0.66 HRH3 (0.49)
SCHEMBL5196668 0.66 DRD2 (0.56) LMNAHTTKDM4EMAPK1
SCHEMBL3247538 0.66 HTR2A (0.66) NR3C1NR3C2PGRADRB1HTT
SCHEMBL23745747 0.65 MC5R (0.56)

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101406469-B Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods LUNDBECK & CO AS H 2012-06-13 CN 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-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
CN-101406469-A Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods LUNDBECK & CO AS H (DK) 2009-04-15 CN disclosed
CN-100446767-C Use of GAL3 receptor antagonists for the manufacture of a medicament for the treatment of depression and/or anxiety and compounds useful in such a method SYNAPTIC PHARMA CORP (DK) 2008-12-31 CN disclosed
US-7465750-B2 Use of GAL3 antagonist for treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (US) 2008-12-16 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-7220775-B2 Compound useful for the treatment of neuropathic pain H. LUNDBECK A/S (DK) 2007-05-22 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
CN-1499970-A Use of GAL3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods �����յٿ�ҩ�����޹�˾ 2004-05-26 CN 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 (6 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 NR3C1 389/4885NR3C2 824/4885PGR 493/4885
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 NR3C1 389/4885NR3C2 824/4885PGR 493/4885
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 NR3C1 314/4885NR3C2 479/4885PGR 509/4885
US-20040127502-A1 Use of GAL3 antagonist for treatment of depression GALR3, GALR2, GALR1 NR3C1 449/4885NR3C2 859/4885PGR 473/4885
US-20040092570-A1 GAL3 antagonists for the treatment of neuropathic pain GALR3, GALR2, GALR1 NR3C1 1587/4885NR3C2 2661/4885PGR 1512/4885
US-20070259942-A1 Use of GAL3 antagonist for treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR2, GALR1 NR3C1 454/4885NR3C2 881/4885PGR 656/4885

“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.