SCHEMBL2667557

SCHEMBL2667557

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

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.39
▸ GCK P35557 5/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TSPO P30536 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CXCR1 P25024 1/20 0.36
▸ CXCR2 P25025 1/20 0.36

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
SCHEMBL2668579 0.87 ATM (0.39) ATMGCKALDH1A1MEN1KMT2A
SCHEMBL2668583 0.79 MCL1 (0.42) ATMMEN1KMT2ARAB9AKDM4E
SCHEMBL1330053 0.77 GCK (0.71) GCK
SCHEMBL9072456 0.76 CXCR1 (0.45) GCKRAB9AMAPTCXCR1CXCR2
SCHEMBL1328203 0.76 GCK (0.67) GCKALDH1A1
SCHEMBL1330033 0.75 GCK (0.47) GCK
SCHEMBL16488514 0.74 GCK (0.39) GCK
SCHEMBL1329481 0.74 GCK (0.67) GCK
SCHEMBL14485982 0.74 CXCR1 (0.40) GCKALDH1A1MEN1KMT2ARAB9A
SCHEMBL28897181 0.73 CYP1A2 (0.59) ATMALDH1A1RAB9ALMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007117381-A2 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-10-18 — — WO disclosed
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