SCHEMBL9119863

SCHEMBL9119863

COc1ccc(C=CC(=O)O)c(C(C)CC[SiH2]C(O[Si](C)(C)C)O[Si](C)(C)C)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ABCG2 Q9UNQ0 1/20 0.37
CYP1A1 P04798 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP1B1 Q16678 2/20 0.36
PTGER4 P35408 2/20 0.35
PTGER2 P43116 2/20 0.35
PTGER3 P43115 1/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPT P10636 1/20 0.35
HTR1A P08908 1/20 0.35
HTR2C P28335 1/20 0.35
NFE2L2 Q16236 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35

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
SCHEMBL9119854 1.00 KDM4E (0.43) KDM4EABCG2CYP1A1CYP1A2CYP2D6
SCHEMBL647361 0.88 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL647363 0.88 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL646206 0.81 KDM4E (0.48) KDM4EABCG2CYP1A1CYP1A2CYP2D6
SCHEMBL646208 0.81 KDM4E (0.48) KDM4EABCG2CYP1A1CYP1A2CYP2D6
SCHEMBL645499 0.73 KDM4E (0.41) KDM4EPTGER4PTGER2PTGER3ALDH1A1
SCHEMBL645501 0.73 KDM4E (0.41) KDM4EPTGER4PTGER2PTGER3ALDH1A1
SCHEMBL9440557 0.73 KDM4E (0.41) KDM4EPTGER4PTGER2PTGER3ALDH1A1
SCHEMBL9440571 0.73 KDM4E (0.41) KDM4EPTGER4PTGER2PTGER3ALDH1A1
SCHEMBL6675232 0.71 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10MAPT

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