SCHEMBL2434971

SCHEMBL2434971

COC(=O)c1ccccc1NC(=O)c1cn2ccccc2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.61
RAB9A P51151 5/20 0.61
POLB P06746 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
TP53 P04637 2/20 0.58
MAPT P10636 4/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.55
KDM4E B2RXH2 3/20 0.55
PKM P14618 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 3/20 0.52
PTGS1 P23219 1/20 0.51
PTGS2 P35354 1/20 0.51
TSHR P16473 3/20 0.50
MAPK1 P28482 2/20 0.50
HSD17B10 Q99714 2/20 0.50
GAA P10253 1/20 0.50
PPARG P37231 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
SCHEMBL2442592 0.86 NPC1 (0.69) NPC1RAB9APOLBTP53MAPT
SCHEMBL1583201 0.81 PTGS1 (0.66) NPC1RAB9APOLBTP53MAPT
SCHEMBL2436563 0.78 RAB9A (0.69) NPC1RAB9APOLBTP53MAPT
SCHEMBL2435738 0.76 RAB9A (0.58) NPC1RAB9APOLBMAPTCYP1A2
SCHEMBL2468923 0.76 RAB9A (1.00) NPC1RAB9APOLBTDP1MAPT
SCHEMBL15924280 0.76 MAPT (0.72) NPC1RAB9APOLBTP53MAPT
SCHEMBL23657493 0.74 RAB9A (0.80) NPC1RAB9APOLBTP53MAPT
SCHEMBL17903825 0.74 NPC1 (0.59) NPC1RAB9APOLBTP53MAPT
SCHEMBL11446166 0.73 POLB (0.60) NPC1RAB9APOLBTDP1TP53
SCHEMBL4620787 0.73 MAPT (1.00) NPC1RAB9APOLBTP53MAPT

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
EP-2225241-B1 Derivatives of N-phenyl-imidazo-(1,2-A)-pyridine-2-carboxamides, preparation thereof and therapeutic application thereof SANOFI SA (FR) 2011-09-14 EP claimed
US-20100317685-A1 N-PHENYL-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2010-12-16 US claimed
CN-101910176-A N-phenylimidazo [1,2-a ] pyridine-2-carboxamide derivatives, their preparation and their therapeutic use SANOFI AVENTIS 2010-12-08 CN claimed
US-20100317685-A1 N-PHENYL-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2010-12-16 US disclosed
CN-101910176-A N-phenylimidazo [1,2-a ] pyridine-2-carboxamide derivatives, their preparation and their therapeutic use SANOFI AVENTIS 2010-12-08 CN 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 (1 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-20100317685-A1 N-PHENYL-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION ARG2, IDH2, GLS NPC1 643/4885RAB9A 1246/4885POLB 2433/4885

“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.