SCHEMBL4017041

SCHEMBL4017041

C1C[SiH2][SiH2][SiH2]O1.COc1c(C=CC(=O)O)cc(CCC(C)C)c(OC)c1OC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
ALOX5 P09917 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 3/20 0.32
HTR1A P08908 1/20 0.32
HPGD P15428 1/20 0.32
HTR2C P28335 1/20 0.32
HSD17B10 Q99714 1/20 0.32
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL2290706 0.84 ALOX5 (0.43) KDM4EALOX5CA12CA1CA2
SCHEMBL22070142 0.69 ALOX5 (0.37) ALOX5TDP1NFKB1NFKB2RELA
SCHEMBL21625542 0.69 ALOX5 (0.39) ALOX5TDP1NFKB1NFKB2RELA
SCHEMBL2851113 0.69 ALOX5 (0.36) ALOX5TDP1NFKB1NFKB2RELA
SCHEMBL290383 0.65 PTGER4 (0.48) KDM4EALOX5CA12CA1CA2
SCHEMBL196086 0.65 PTGER4 (0.48) KDM4EALOX5CA12CA1CA2
SCHEMBL2290699 0.65 KDM4E (0.51) KDM4EALOX5CA12CA1CA2
SCHEMBL16048857 0.64 ALOX5 (0.47) KDM4EALOX5CA12CA1CA2
SCHEMBL16048858 0.64 ALOX5 (0.47) KDM4EALOX5CA12CA1CA2
SCHEMBL28238937 0.63 CA1 (0.45) KDM4EALOX5CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1352637-B1 HAIR GROWTH INHIBITORS AND COMPOSITIONS CONTAINING THE SAME SHISEIDO CO LTD (JP) 2009-07-01 EP disclosed
US-7285294-B2 Hair growth inhibitors and composition containing same SHISEIDO COMPANY, LTD. (JP) 2007-10-23 US disclosed
US-20050175576-A1 Hair growth inhibitors and composition containing same SHISEIDO CO., LTD. (JP) 2005-08-11 US disclosed
US-20040047833-A1 Hair growth inhibitors and compositions containing the same SHISEIDO COMPANY, LTD. (JP) 2004-03-11 US disclosed
EP-1352637-A1 HAIR GROWTH INHIBITORS AND COMPOSITIONS CONTAINING THE SAME SHISEIDO COMPANY LIMITED (JP) 2003-10-15 EP disclosed