SCHEMBL9608908

SCHEMBL9608908

O=CCc1ccc(N(c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)c2ccc(CC=O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.45
CYP19A1 P11511 2/20 0.44
CYP11B2 P19099 2/20 0.44
ESR1 P03372 2/20 0.41
CYP2D6 P10635 1/20 0.39
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 2/20 0.37
ESR2 Q92731 1/20 0.37
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL2210133 0.85 CYP19A1 (0.57) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL278974 0.84 CYP19A1 (0.46) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL10070915 0.84 PTGS2 (0.47) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL7752070 0.84 PTGS2 (0.50) PTGS2CYP19A1CYP11B2ESR1KMT2A
SCHEMBL279130 0.84 AKR1B1 (0.46) PTGS2CYP19A1CYP11B2ESR1KMT2A
SCHEMBL6032733 0.84 CYP19A1 (0.55) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL14018365 0.84 CYP19A1 (0.55) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL10128938 0.84 CYP19A1 (0.55) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL133557 0.84 CYP19A1 (0.55) PTGS2CYP19A1CYP11B2ESR1CYP2D6
SCHEMBL7570019 0.84 CYP19A1 (0.55) PTGS2CYP19A1CYP11B2ESR1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273517-B2 Method of manufacturing electrophotographic photoreceptor, electrophotographic photoreceptor, image-forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2012-09-25 US disclosed
US-20120134713-A1 METHOD OF MANUFACTURING ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE-FORMING APPARATUS, AND PROCESS CARTRIDGE FUJI XEROX CO., LTD. (JP) 2012-05-31 US disclosed