SCHEMBL9737906

SCHEMBL9737906

COCC1(C)Oc2ccc(C(=O)OC)cc2C(Oc2ccc(=O)[nH]n2)=C1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.35
RAB9A P51151 4/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
CNR2 P34972 3/20 0.33
CNR1 P21554 2/20 0.33
MAPT P10636 2/20 0.32
PDPK1 O15530 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
TTR P02766 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
MCL1 Q07820 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32

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 0.81 CNR2 (0.36) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9735503 0.81 ALOX5 (0.35) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9736448 0.81 ALOX5 (0.35) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9733368 0.80 ALOX5 (0.36) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9736109 0.79 CNR2 (0.35) ALOX5RAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL9736085 0.72 IDO1 (0.34) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9734818 0.71 ALOX5 (0.36) ALOX5RAB9AKDM4EALDH1A1NPC1
SCHEMBL9735313 0.70 ALOX5 (0.32) ALOX5RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL9732736 0.70 KDM4E (0.33) RAB9AKDM4EALDH1A1NPC1LMNA
SCHEMBL9737143 0.69 ALDH1A1 (0.36) RAB9AKDM4EALDH1A1NPC1SMN1; SMN2

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-5130322-A CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-07-14 US disclosed