SCHEMBL9639720

SCHEMBL9639720

COC(=O)c1cccc(C=Cc2ccccc2)c1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
BACE1 P56817 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NFE2L2 Q16236 2/20 0.46
TRPA1 O75762 1/20 0.46
POLB P06746 3/20 0.46
MAPT P10636 4/20 0.45
SNCA P37840 3/20 0.45
KDM4E B2RXH2 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL2658197 0.87 BACE1 (0.61) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL2658196 0.87 BACE1 (0.61) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL30423635 0.87 BACE1 (0.61) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL29227737 0.87 BACE1 (0.61) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL9294233 0.85 CA12 (0.61) HSD17B10CYP1A2CYP2C19NPC1RAB9A
SCHEMBL7706013 0.85 HSD17B10 (0.52) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL9294229 0.85 CA12 (0.61) HSD17B10CYP1A2CYP2C19NPC1RAB9A
SCHEMBL29627912 0.84 HSD17B10 (0.51) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL29627933 0.84 HSD17B10 (0.51) HSD17B10CYP1A2CYP2C19BACE1NPC1
SCHEMBL8694349 0.80 BACE1 (0.47) HSD17B10CYP1A2CYP2C19BACE1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118755208-A Flame-retardant wear-resistant PVC material and preparation method thereof 江苏同花盛鞋业有限公司 2024-10-11 CN claimed
CN-118755208-A Flame-retardant wear-resistant PVC material and preparation method thereof 江苏同花盛鞋业有限公司 2024-10-11 CN disclosed
CN-118755208-A Flame-retardant wear-resistant PVC material and preparation method thereof 江苏同花盛鞋业有限公司 2024-10-11 CN disclosed
US-5164100-A Stilbene unit incorporated into polyester LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-11-17 US disclosed
US-5082578-A Fabric care compositions containing a polymeric fluorescent whitening agent LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-01-21 US disclosed
US-5039782-A Containing a fluorescent group and a hydrophilic group; antisoilants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1991-08-13 US disclosed