SCHEMBL7574285

SCHEMBL7574285

CCOC(=O)c1ccc(Cl)c(N)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
TSHR P16473 1/20 0.50
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA12 O43570 3/20 0.47
CA9 Q16790 3/20 0.47
CA7 P43166 2/20 0.46
CA14 Q9ULX7 2/20 0.46
MAOA P21397 2/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
BAZ2B Q9UIF8 1/20 0.44
BAZ2A Q9UIF9 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
SCHEMBL23413057 0.88 ALDH1A1 (0.53) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL30093973 0.84 CYP4F2 (0.55) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL543452 0.83 ABL1 (0.53) ALDH1A1HSD17B10TSHRCA1CA2
SCHEMBL7582549 0.83 CYP4F2 (0.54) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL7575316 0.81 CYP4F2 (0.47) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL6311143 0.81 CYP4F2 (0.53) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL28165696 0.81 ALDH1A1 (0.53) ALDH1A1HSD17B10TSHRCA1CA2
SCHEMBL7582968 0.80 CYP4F2 (0.55) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL24717780 0.80 ALDH1A1 (0.56) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR
SCHEMBL30798553 0.80 ALDH1A1 (0.56) ALDH1A1HSD17B10CYP4F2CYP4A11TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-213286769-U Reaction device 联化科技(台州)有限公司 2021-05-28 CN disclosed
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP disclosed
CN-1082790-C Herbicides RHONE POULENE AGRICULTURE LTD (GB) 2002-04-17 CN disclosed
EP-0625505-B1 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1998-10-28 EP disclosed
CN-1100261-A Herbicides RHONE POULENC AGRICULTURE (GB) 1995-03-22 CN disclosed
US-5374606-A Pre- and postemergence RHONE-POULENC AGRICULTURE LIMITED (GB) 1994-12-20 US disclosed
EP-0625505-A2 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP disclosed