SCHEMBL10020263

SCHEMBL10020263

COC(=O)c1ccc(C(=O)CO)cc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.46
ALDH1A1 P00352 8/20 0.46
HSD17B10 Q99714 6/20 0.46
HPGD P15428 4/20 0.46
MAPT P10636 3/20 0.46
GAA P10253 3/20 0.46
GLA P06280 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
NOTUM Q6P988 1/20 0.45
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK4 Q16654 1/20 0.41

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
SCHEMBL70233 0.84 KDM4E (0.62) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL16950448 0.81 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL1483525 0.81 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL3121267 0.81 HSD17B10 (0.52) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL29606243 0.81 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11885424 0.81 KDM4E (0.73) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL12920465 0.81 MAPT (0.50) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL1483367 0.81 MAPT (0.59) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL14958355 0.80 KDM4E (0.53) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL5089887 0.80 KDM4E (0.49) KDM4EALDH1A1HSD17B10HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8901247-B2 Responsive polymer system and nanohybrid thin films THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-12-02 US disclosed
US-20120038249-A1 NOVEL RESPONSIVE POLYMER SYSTEM AND NANOHYBRID THIN FILMS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-02-16 US disclosed