SCHEMBL9308535

SCHEMBL9308535

c1ccc([C](c2ccccc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.58
CES1 P23141 1/20 0.58
F2 P00734 1/20 0.54
PLG P00747 1/20 0.54
PLAU P00749 1/20 0.54
KLKB1 P03952 1/20 0.54
KLK1 P06870 1/20 0.54
PRSS1 P07477 1/20 0.54
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
EGFR P00533 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
PKM P14618 1/20 0.48

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
SCHEMBL2837486 0.93 CES2 (0.65) CES2CES1F2PLGPLAU
SCHEMBL6986455 0.90 CYP1A2 (0.54) CES2CES1F2PLGPLAU
SCHEMBL10517865 0.81 CES2 (0.58) CES2CES1F2PLGPLAU
SCHEMBL4088285 0.77 CES2 (0.54) CES2CES1F2PLGPLAU
SCHEMBL14876982 0.77 CES2 (0.87) CES2CES1MEN1KMT2AMAPT
Beta-Naphtoic Acid SCHEMBL9008562 0.77 CES2 (0.65) CES2CES1MEN1KMT2AMAPT
SCHEMBL30500514 0.77 CES2 (0.54) CES2CES1F2PLGPLAU
SCHEMBL29834246 0.77 MEN1 (0.75) CES2CES1MEN1KMT2AMAPT
SCHEMBL15478714 0.77 PLAU (0.61) CES2CES1F2PLGPLAU
SCHEMBL30161362 0.77 CES2 (0.87) CES2CES1MEN1KMT2AMAPT

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
US-5324604-A Multi-active electrophotographic element and imaging process using free radicals as charge transport material EASTMAN KODAK COMPANY (US) 1994-06-28 US claimed
CN-106967107-A The method for producing organo-silicon compound 道康宁东丽株式会社 2017-07-21 CN disclosed
CN-103946185-A Process for producing organosilicon compound DOW CORNING TORAY CO LTD 2014-07-23 CN disclosed
US-5332726-A Anticoagulant RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-07-26 US disclosed
US-5324604-A Multi-active electrophotographic element and imaging process using free radicals as charge transport material EASTMAN KODAK COMPANY (US) 1994-06-28 US disclosed