SCHEMBL9440652

SCHEMBL9440652

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 2/20 0.40
HTR1A P08908 2/20 0.40
HTR2C P28335 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.38
HTT P42858 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PSMB11 A5LHX3 1/20 0.35
PSMA7 O14818 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMA1 P25786 1/20 0.35
PSMA2 P25787 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
SCHEMBL647364 0.79 ALDH1A1 (0.40) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL646209 0.78 GAA (0.44) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL647362 0.75 ALDH1A1 (0.47) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL646617 0.74 MEN1 (0.40) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL9119119 0.71 POLB (0.41) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL9440566 0.70 POLB (0.40) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL647487 0.69 KMT2A (0.38) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL16160031 0.69 GAA (0.53) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL645500 0.68 ABCB1 (0.56) ALDH1A1KDM4EHPGDHTR1AHTR2C
SCHEMBL9119704 0.68 MEN1 (0.39) MEN1KMT2APOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5315022-A Sunscreen SHISEIDO COMPANY LTD. (JP) 1994-05-24 US disclosed