SCHEMBL10708482

SCHEMBL10708482

CC(C(=O)O)(c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
HSD17B10 Q99714 2/20 0.49
ALDH1A1 P00352 2/20 0.49
PPARG P37231 3/20 0.46
PPARA Q07869 3/20 0.46
KIF11 P52732 1/20 0.46
ACP3 P15309 1/20 0.45
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43

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
SCHEMBL4592424 0.91 KDM4E (0.53) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL27347246 0.87 KMT2A (0.49) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL4592642 0.81 CYP2C9 (0.52) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL7287554 0.80 KDM4E (0.53) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL4678773 0.80 KDM4E (0.53) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL503390 0.80 KDM4E (0.46) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL599245 0.79 PPARG (0.52) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL8580845 0.79 ACP3 (0.44) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL668729 0.79 KDM4E (0.51) KDM4EHSD17B10ALDH1A1PPARGPPARA
SCHEMBL11601001 0.79 KIF11 (0.48) KDM4EHSD17B10ALDH1A1PPARGPPARA

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
EP-0179487-B1 2-PHENYLPROPIONIC ACID ESTERS, METHOD FOR OPTICAL RESOLUTION THEREOF AND OPTICALLY ACTIVE SUBSTANCE THEREOF NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-08-10 EP disclosed