SCHEMBL9733368

SCHEMBL9733368

COC(=O)c1ccc2c(c1)C(Oc1ccc(=O)[nH]n1)=C(C=O)C(C)(C)O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PDPK1 O15530 1/20 0.35
CNR2 P34972 4/20 0.35
RAB9A P51151 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
NPC1 O15118 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
MCL1 Q07820 1/20 0.34
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
CNR1 P21554 2/20 0.33
AURKA O14965 1/20 0.33
RAF1 P04049 1/20 0.33
KDM4E B2RXH2 3/20 0.32
MAPK1 P28482 1/20 0.31

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
SCHEMBL9732736 0.90 KDM4E (0.33) RAB9ANPC1KDM4EALDH1A1
SCHEMBL9740084 0.85 CNR2 (0.36) ALOX5PDPK1CNR2RAB9ASMN1; SMN2
SCHEMBL9733370 0.83 KDM4E (0.34) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL9733057 0.80 PDPK1 (0.38) ALOX5PDPK1CNR2RAB9ASMN1; SMN2
SCHEMBL9737906 0.80 ALOX5 (0.35) ALOX5PDPK1CNR2RAB9ASMN1; SMN2
SCHEMBL9735503 0.75 ALOX5 (0.35) ALOX5PDPK1CNR2RAB9ASMN1; SMN2
SCHEMBL9732982 0.70 ALOX5 (0.38) ALOX5PDPK1CNR2RAB9ASMN1; SMN2
SCHEMBL9735940 0.69 KDM4E (0.34) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL2152461 0.68 LMNA (0.51) RAB9ASMN1; SMN2MAPTPOLBKMT2A
SCHEMBL9733029 0.67 ALDH1A1 (0.38) CNR2RAB9ASMN1; SMN2MAPTNPC1

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
US-5143924-A OXODIHYDROPYRIDYL CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-09-01 US disclosed