SCHEMBL3061595

SCHEMBL3061595

C=Cc1cccc2c1Sc1ccccc1O2

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.32

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
SCHEMBL9935195 0.83 MEN1 (0.40) ALDH1A1ATM
SCHEMBL25165183 0.80 ATM (0.31) ATM
SCHEMBL4795404 0.77
SCHEMBL9934469 0.77 ATM (0.34) ATM
SCHEMBL3046459 0.76 ALDH1A1 (0.40) ALDH1A1
SCHEMBL31748025 0.76 ALOX5 (0.40) ATM
SCHEMBL29890913 0.76 ALDH1A1 (0.40) ALDH1A1
SCHEMBL10513618 0.76 GABRA1 (0.38) ALDH1A1ATM
SCHEMBL10515115 0.73 TYMS (0.42) ATM
SCHEMBL18534187 0.73 PTPN5 (0.40) ALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992004897-A1 1-SUBSTITUTED PHENOXATHIIN DERIVATIVES AS ANTIDEPRESSANTS THE WELLCOME FOUNDATION LIMITED (GB) 1992-04-02 WO claimed
US-20100221646-A1 HOLOGRAPHIC RECORDING MEDIUM KABUSHIKI KAISHA TOSHIBA (JP) 2010-09-02 US disclosed
US-5708064-A CONTAINING THERMOSETTING RESIN PPG INDUSTRIES, INC. (US) 1998-01-13 US disclosed
WO-1995010790-A1 HIGH REFRACTIVE INDEX PHOTOCHROMIC OPHTHALMIC ARTICLE PPG INDUSTRIES, INC. (US) 1995-04-20 WO disclosed
WO-1992004897-A1 1-SUBSTITUTED PHENOXATHIIN DERIVATIVES AS ANTIDEPRESSANTS THE WELLCOME FOUNDATION LIMITED (GB) 1992-04-02 WO disclosed