SCHEMBL9119113

SCHEMBL9119113

COc1cc(C=CC(=O)O)c(CCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C)c(OC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.45
ALDH1A1 P00352 8/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 2/20 0.45
HTR1A P08908 1/20 0.45
HTR2C P28335 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.39
CYP2C9 P11712 1/20 0.38
PKM P14618 2/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36

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
SCHEMBL9119098 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL9440538 0.97 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL9440555 0.97 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL9440500 0.82 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL9440511 0.82 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL646614 0.80 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL646616 0.80 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL10610356 0.80 ALOX5 (0.51) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL10606235 0.80 ALOX5 (0.51) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL645501 0.78 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0350314-B1 Silicone type cinnamic acid derivative, preparation method thereof, uv-ray absorber, and external skin treatment agent. SHISEIDO CO LTD (JP) 1995-12-13 EP disclosed
US-5315022-A Sunscreen SHISEIDO COMPANY LTD. (JP) 1994-05-24 US disclosed
US-5093511-A SILICONE TYPE CINNAMIC ACID DERIVATIVE, PREPARATION METHOD THEREOF, UV-RAY ABSORBER, AND EXTERNAL SKIN TREATMENT AGENT SHISEIDO COMPANY, LTD. (JP) 1992-03-03 US disclosed