SCHEMBL3579347

SCHEMBL3579347

Cn1ccc2cc(NC(=O)c3cc4cc(F)ccc4n3Cc3cccc(F)c3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 12/20 0.51
MAOB P27338 1/20 0.50
F10 P00742 2/20 0.48
NOTUM Q6P988 1/20 0.44
CCR2 P41597 1/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.43
ABCB1 P08183 1/20 0.43

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
SCHEMBL4655292 0.94 MAOB (0.50) ECE1MAOBF10NOTUMCCR2
SCHEMBL4655386 0.94 ECE1 (0.51) ECE1MAOBF10NOTUMCCR2
SCHEMBL4656230 0.94 ECE1 (0.60) ECE1MAOBF10NOTUMCCR2
SCHEMBL4655390 0.94 MAOB (0.50) ECE1MAOBCCR2PTGDR2ABCB1
SCHEMBL4655266 0.94 ECE1 (0.56) ECE1MAOBF10NOTUMPTGDR2
SCHEMBL4655342 0.93 ECE1 (0.49) ECE1MAOBF10CCR2PTGDR2
SCHEMBL4657644 0.93 ECE1 (0.52) ECE1NOTUMCCR2PTGDR2
SCHEMBL4655305 0.93 ECE1 (0.46) ECE1MAOBNOTUMCCR2PTGDR2
SCHEMBL4655298 0.93 ECE1 (0.49) ECE1MAOBF10
SCHEMBL4655303 0.93 ECE1 (0.49) ECE1MAOBF10CCR2ABCB1

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 ECE1 1424/4885MAOB 43/4885F10 1655/4885
US-20080227843-A1 THERAPEUTIC USE OF N-(1H-INDOLYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES NPY5R, TPH2, TPH1 ECE1 1609/4885MAOB 45/4885F10 1905/4885
US-20090286846-A1 Therapeutic use of N-(1H-Indolyl)-1H-indole-2-carboxamide derivatives NPY5R, TPH2, TPH1 ECE1 1609/4885MAOB 45/4885F10 1905/4885

“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.