SCHEMBL9608744

SCHEMBL9608744

Cc1ccc(C(=Cc2ccc(N(c3ccc(CCCO)cc3)c3ccc(CC4CO4)cc3)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
PTGS2 P35354 2/20 0.35
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CYP4A11 Q02928 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL279561 0.91 PTGS2 (0.41) TP53PTGS2MEN1KMT2AALDH1A1
SCHEMBL9608959 0.89 MEN1 (0.36) PTGS2MEN1KMT2A
SCHEMBL9607505 0.81 TP53 (0.36) TP53PTGS2THRATHRB
SCHEMBL9098089 0.81 PTGS2 (0.46) TP53PTGS2CYP4A11MEN1KMT2A
SCHEMBL13313028 0.80 PTGS2 (0.36) TP53PTGS2MEN1KMT2AALDH1A1
SCHEMBL279256 0.80 PTGS2 (0.36) TP53PTGS2MEN1KMT2AALDH1A1
SCHEMBL279272 0.80 CYP19A1 (0.39) PTGS2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14950688 0.75 PTGS2 (0.48) TP53PTGS2MEN1KMT2AALDH1A1
SCHEMBL12572204 0.75 PTGS2 (0.48) TP53PTGS2MEN1KMT2AALDH1A1
SCHEMBL13337948 0.75 SMN1; SMN2 (0.43) TP53PTGS2MEN1KMT2AALDH1A1

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