SCHEMBL3569792

SCHEMBL3569792

Cn1ccc2cc(NC(=O)c3cc4ccccc4n3-c3cccc(C(F)(F)F)c3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.58
ECE1 P42892 1/20 0.48
THRB P10828 1/20 0.42
MAOB P27338 1/20 0.42
NOTUM Q6P988 1/20 0.42
RORC P51449 1/20 0.42
MEN1 O00255 2/20 0.41
TP53 P04637 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
MAPT P10636 2/20 0.41
CYP2C19 P33261 2/20 0.41
HTR2B P41595 2/20 0.41
RECQL P46063 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GPR142 Q7Z601 1/20 0.41
HTR2C P28335 2/20 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
SCHEMBL4655408 0.92 PLA2G10 (0.48) PLA2G10ECE1THRBMAOBNOTUM
SCHEMBL4656120 0.90 ECE1 (0.50) PLA2G10ECE1MAOBNOTUMRORC
SCHEMBL4656220 0.87 ECE1 (0.59) ECE1MAOBNOTUMMEN1TP53
SCHEMBL4656242 0.86 ECE1 (0.49) ECE1THRBMAOBNOTUMMEN1
SCHEMBL4655289 0.83 ECE1 (0.53) ECE1MAOBNOTUMMEN1TP53
SCHEMBL4656319 0.83 ECE1 (0.50) ECE1MAOBNOTUMMEN1TP53
SCHEMBL28788204 0.83 ECE1 (0.48) PLA2G10ECE1MAOBNOTUMMEN1
SCHEMBL3574151 0.82 PPARG (0.64) ECE1PPARG
SCHEMBL4655241 0.82 NOTUM (0.49) ECE1MAOBNOTUMMEN1TP53
SCHEMBL3158425 0.82 PLA2G10 (0.57) PLA2G10ECE1MAOBKDRPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101010297-B N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS 2011-07-27 CN claimed
EP-1776340-B1 N-(1H-INDOLYL)-H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI AVENTIS (FR) 2008-12-03 EP claimed
CN-101010297-B N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS 2011-07-27 CN disclosed
US-7781477-B2 Therapeutic use of N-(1H-Indolyl)-1H-indole-2-carboxamide derivatives SANOFI-AVENTIS (FR) 2010-08-24 US disclosed
US-20090286846-A1 Therapeutic use of N-(1H-Indolyl)-1H-indole-2-carboxamide derivatives SANOFI-AVENTIS (FR) 2009-11-19 US disclosed
US-7582671-B2 Therapeutic use of N-(1H-indolyl)-1H-indole-2-carboxamide derivatives SANOFI-AVENTIS (FR) 2009-09-01 US disclosed
EP-1776340-B1 N-(1H-INDOLYL)-H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI AVENTIS (FR) 2008-12-03 EP disclosed
US-20080227843-A1 THERAPEUTIC USE OF N-(1H-INDOLYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES SANOFI-AVENTIS (FR) 2008-09-18 US disclosed
US-7384969-B2 N-(1H-indolyl)-1H-indole-2-carboxamide derivatives, their preparation and their therapeutic use SANOFI-AVENTIS (FR) 2008-06-10 US disclosed
CN-101010297-A N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS (FR) 2007-08-01 CN disclosed
US-20070149602-A1 N-(1H-INDOLYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI-AVENTIS (FR) 2007-06-28 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 (3 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-20070149602-A1 N-(1H-INDOLYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE IDO1, IDO2, NPY5R PLA2G10 3074/4885ECE1 1424/4885THRB 1537/4885
US-20080227843-A1 THERAPEUTIC USE OF N-(1H-INDOLYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES NPY5R, TPH2, TPH1 PLA2G10 3198/4885ECE1 1609/4885THRB 1429/4885
US-20090286846-A1 Therapeutic use of N-(1H-Indolyl)-1H-indole-2-carboxamide derivatives NPY5R, TPH2, TPH1 PLA2G10 3198/4885ECE1 1609/4885THRB 1429/4885

“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.