SCHEMBL4151515

SCHEMBL4151515

CN(C)c1ccc(NC(=O)c2cc3cc(F)ccc3n2Cc2ccc(F)cc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
TP53 P04637 1/20 0.48
ECE1 P42892 4/20 0.47
CCR2 P41597 1/20 0.47
NPSR1 Q6W5P4 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 1/20 0.45
PTGDR2 Q9Y5Y4 5/20 0.45
CTNNB1 P35222 1/20 0.45
TCF7L2 Q9NQB0 1/20 0.45
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL4151209 0.94 ECE1 (0.50) ECE1CCR2PTGDR2F10
SCHEMBL4150411 0.92 F10 (0.47) ECE1CCR2PTGDR2F10MAOB
Hydrochloric Acid SCHEMBL4143378 0.91 F10 (0.47) ECE1CCR2PTGDR2F10MAOB
SCHEMBL942166 0.85 F10 (0.44) ECE1PTGDR2F10MAOBPIK3CA
SCHEMBL4150551 0.84 PPARG (0.46) ECE1CCR2F10
SCHEMBL4158624 0.84 PTGDR2 (0.45) MAPTTP53ECE1CCR2PTGDR2
SCHEMBL4167504 0.80 MAPT (0.41) MAPTTP53ECE1CCR2NPSR1
SCHEMBL4146206 0.80 ECE1 (0.53) MAPTTP53ECE1CCR2PTGDR2
SCHEMBL2892433 0.79 ECE1 (0.56) MAPTTP53ECE1CCR2NPSR1
SCHEMBL4157656 0.79 ECE1 (0.49) MAPTTP53ECE1CCR2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481745-B2 N-(aminoheteroaryl)-1H-indole-2-carboxamide derivatives, preparation thereof and therapeutic use therof SANOFI (FR) 2013-07-09 US disclosed
US-20120264944-A1 N-(AMINOHETEROARYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEROF SANOFI (FR) 2012-10-18 US disclosed
EP-2046775-B1 N-(AMINOHETEROARYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2012-08-22 EP disclosed
US-8227489-B2 N-(aminoheteroaryl)-1H-indole-2-carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-07-24 US disclosed
US-20090156809-A1 N-(AMINOHETEROARYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-06-18 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 (2 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-20120264944-A1 N-(AMINOHETEROARYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEROF IDO2, IDO1, IKZF3 MAPT 2838/4885TP53 819/4885ECE1 2326/4885
US-20090156809-A1 N-(AMINOHETEROARYL)-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF IDO1, IDO2, CNKSR1 MAPT 3749/4885TP53 2725/4885ECE1 1630/4885

“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.