SCHEMBL9737456

SCHEMBL9737456

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

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 3/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
S100A4 P26447 1/20 0.30
KDR P35968 1/20 0.30
TLK2 Q86UE8 2/20 0.30
SYK P43405 1/20 0.30
AURKB Q96GD4 1/20 0.30
INCENP Q9NQS7 1/20 0.30

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
SCHEMBL9740084 0.90 CNR2 (0.36) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9732736 0.84 KDM4E (0.33) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9737886 0.79 TLK2 (0.32) ALDH1A1KDM4ESMN1; SMN2S100A4TLK2
SCHEMBL9733368 0.75 ALOX5 (0.36) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL9737102 0.70 CNR2 (0.37) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9737735 0.67 S100A4 (0.35) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL9735503 0.67 ALOX5 (0.35) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9372031 0.67 KDM4E (0.33) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9735400 0.65 KDM4E (0.35) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL9737676 0.65 ALDH1A1 (0.39) ALDH1A1RAB9AMEN1KMT2ANPSR1

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