SCHEMBL4896485

SCHEMBL4896485

O=C(c1ccccc1)C(C(=O)c1ccccc1)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.54
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
CES1 P23141 3/20 0.48
ESR1 P03372 2/20 0.47
ESR2 Q92731 2/20 0.47
CYP3A4 P08684 2/20 0.47
ALDH1A1 P00352 2/20 0.47
CA2 P00918 4/20 0.43
CA4 P22748 3/20 0.43
CA1 P00915 3/20 0.43
CA12 O43570 2/20 0.43
CA3 P07451 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
HSPD1 P10809 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL7868201 0.82 CES2 (0.52) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL5427609 0.80 CES2 (0.50) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL3220949 0.80 CES2 (0.55) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL8519062 0.80 CES2 (0.50) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL14627381 0.79 ESR1 (0.57) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL16568774 0.79 ESR1 (0.52) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL8464379 0.78 CES1 (0.52) CES2KMT2AMEN1LMNAMAPT
SCHEMBL16516134 0.76 CES2 (0.55) CES2KMT2AMEN1RAB9ALMNA
SCHEMBL4206889 0.75 CA2 (0.48) CES2KMT2AMEN1RAB9ALMNA
Benzil SCHEMBL9666334 0.72 CES2 (0.95) CES2KMT2AMEN1RAB9ALMNA

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-8288066-B2 Electroconductive support with a photosensitive layer of an arylamine-based compound; high sensitivity, chargeability, residual potential, light resistance MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-16 US disclosed
US-20080193867-A1 Electrophotographic Photoreceptor and Image-Forming Apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2008-08-14 US disclosed