SCHEMBL8917811

SCHEMBL8917811

CC(C)(C)[Si](C)(C)OCC(C=CCOS(C)(=O)=O)Cc1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
CYP24A1 Q07973 1/20 0.30

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
SCHEMBL8917803 1.00 BTN3A1 (0.31) BTN3A1ALDH1A1MAPTCYP24A1
SCHEMBL7663381 0.78 TAAR1 (0.37) BTN3A1
SCHEMBL8917913 0.74 CTSL (0.40) BTN3A1MAPT
SCHEMBL8917915 0.74 CTSL (0.40) BTN3A1MAPT
SCHEMBL4698511 0.70 CYP1A2 (0.54)
SCHEMBL10950187 0.70 KDM4E (0.31) ALDH1A1
SCHEMBL14967010 0.70 KDM4E (0.31) ALDH1A1
SCHEMBL3428434 0.68 ADRB2 (0.40)
SCHEMBL3428431 0.68 ADRB2 (0.40)
SCHEMBL5788640 0.68 EPHX1 (0.50)

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-5686565-A ANTIINFLAMMATORY AGENTS SCIOS INC. (US) 1997-11-11 US disclosed