SCHEMBL28801702

SCHEMBL28801702

CCOC(=O)c1ccc(C(=O)OC)cc1CC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
ALDH1A1 P00352 6/20 0.52
MAPT P10636 4/20 0.52
HPGD P15428 4/20 0.52
CA12 O43570 4/20 0.50
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA7 P43166 4/20 0.50
CA9 Q16790 4/20 0.50
CA14 Q9ULX7 4/20 0.50
HSD17B10 Q99714 2/20 0.50
TP53 P04637 1/20 0.50
GLA P06280 1/20 0.50
GAA P10253 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
HSD17B2 P37059 1/20 0.49
TSHR P16473 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL27856604 0.94 CA12 (0.54) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL12796984 0.90 KDM4E (0.62) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL12225855 0.87 TSHR (0.56) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL20017848 0.86 KDM4E (0.49) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL20996786 0.85 KDM4E (0.56) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL17694807 0.85 HRH3 (0.51) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL29586829 0.85 CA12 (0.49) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL25217994 0.84 ALDH1A1 (0.53) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL4209892 0.84 CA12 (0.66) KDM4EALDH1A1MAPTHPGDCA12
SCHEMBL11146746 0.83 KDM4E (0.53) KDM4EALDH1A1MAPTHPGDCA12

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
CN-103038269-B For the preparation of the method for degradable polymer network MEDISSE B.V. (NL) 2015-08-26 CN disclosed
CN-103038269-A Method for preparing a degradable polymer network UNIV TWENTE 2013-04-10 CN disclosed