SCHEMBL9119870

SCHEMBL9119870

COc1ccc(C=C(C(=O)O)C(C)CC[SiH2]C(O[Si](C)(C)C)O[Si](C)(C)C)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.40
KDM4E B2RXH2 3/20 0.40
HTT P42858 2/20 0.40
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AKR1C3 P42330 1/20 0.39
NFE2L2 Q16236 1/20 0.38
AKR1C2 P52895 1/20 0.38
TTR P02766 1/20 0.38
SNCA P37840 1/20 0.38
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38

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
SCHEMBL647364 0.88 ALDH1A1 (0.40) ALDH1A1TDP1GAACYP1A2KDM4E
SCHEMBL646209 0.79 GAA (0.44) ALDH1A1TDP1TAS1R3TAS1R1GAA
SCHEMBL645502 0.69 MEN1 (0.38) ALDH1A1GAACYP1A2KDM4EHTT
SCHEMBL9440575 0.68 POLB (0.38) ALDH1A1GAACYP1A2KDM4EHTT
SCHEMBL20335193 0.67 ALDH1A1 (0.44) ALDH1A1TDP1GAACYP1A2KDM4E
SCHEMBL16160025 0.67 GAA (0.67) ALDH1A1TDP1GAACYP1A2KDM4E
SCHEMBL9440652 0.67 MEN1 (0.40) ALDH1A1TDP1GAACYP1A2KDM4E
SCHEMBL6675235 0.67 POLB (0.36) ALDH1A1GAAKDM4EHTTHPGD
SCHEMBL23761193 0.66 GAA (0.65) ALDH1A1TDP1GAACYP1A2KDM4E
SCHEMBL7813363 0.66 GAA (0.75) ALDH1A1TDP1GAACYP1A2KDM4E

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