SCHEMBL11087697

SCHEMBL11087697

CC(c1ccccc1)c1cc2c(cc1O)OCO2

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.69
CYP2D6 P10635 2/20 0.69
CYP2C9 P11712 2/20 0.69
CYP2C19 P33261 2/20 0.69
CYP1A2 P05177 1/20 0.69
ALOX15 P16050 1/20 0.69
P4HB P07237 10/20 0.58
TYR P14679 1/20 0.54
SMAD3 P84022 6/20 0.48
STAT3 P40763 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL16900583 0.87 CYP3A4 (0.74) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL24598730 0.84 CYP3A4 (0.69) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL24598746 0.84 P4HB (0.58) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL21363661 0.83 P4HB (0.61) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL14284020 0.83 P4HB (0.61) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL14284006 0.82 CYP3A4 (1.00) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL24598755 0.82 CYP1A2 (0.67) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL20715936 0.81 CYP1A2 (0.65) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL7756045 0.80 TYR (0.71) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL24598762 0.79 CYP1A2 (0.63) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515192-B1 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH CO LTD (JP) 2015-07-15 EP disclosed
US-7314693-B2 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2008-01-01 US disclosed
US-7314693-B2 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2008-01-01 US disclosed
US-4482728-A ANTIFERTILITY AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1984-11-13 US disclosed
US-4357344-A Polybutylbenzylphenols and benzyl-3,4-methylenedioxybenzenes in insect population control THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-11-02 US disclosed
US-4342777-A GROWTH INHIBITOR FOR MOSQUITO LARVAE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-08-03 US disclosed