SCHEMBL2668579

SCHEMBL2668579

COC(=O)CCSc1cnc(N)c(Oc2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.39
▸ GCK P35557 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TRPC6 Q9Y210 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ FYN P06241 1/20 0.36
▸ TSPO P30536 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL9072456 0.89 CXCR1 (0.45) GCKRAB9ATRPC6MAPT
SCHEMBL2667557 0.87 ATM (0.39) ATMGCKALDH1A1MEN1KMT2A
SCHEMBL2668583 0.82 MCL1 (0.42) ATMMEN1KMT2ARAB9ACYP1A2
SCHEMBL9072457 0.81 CYP1A2 (0.40) ATMALDH1A1MEN1KMT2ARAB9A
SCHEMBL15196365 0.80 MAPK1 (0.43) FYN
SCHEMBL16488510 0.78 CXCR1 (0.38) ALDH1A1KMT2AMAPT
SCHEMBL1329022 0.77 CXCR1 (0.40) ALDH1A1MEN1KMT2ARAB9ACYP1A2
SCHEMBL1330053 0.77 GCK (0.71) GCK
SCHEMBL16429390 0.76 HSD17B10 (0.36) ALDH1A1MEN1KMT2ARAB9ACYP1A2
SCHEMBL1328203 0.75 GCK (0.67) GCKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2543667-A1 2-aminopyridine analogs as glucokinase activators Array Biopharma, Inc. (US) 2013-01-09 — — EP disclosed
WO-2007117381-A9 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2008-03-27 — — WO disclosed
WO-2007117381-A2 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-10-18 — — WO disclosed
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