SCHEMBL19237136

SCHEMBL19237136

Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(Cc6ccc(/C(=C/N(c7ccc(-c8ccc(N(C=C(c9ccccc9)c9ccccc9)c9ccc(C)cc9C)cc8)cc7)c7ccc(C)cc7C)c7ccccc7)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
SRD5A2 P31213 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PPARG P37231 2/20 0.30
PPARD Q03181 2/20 0.30
PPARA Q07869 2/20 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
SCHEMBL25071486 0.89 MAPT (0.35) PTGESALOX5NFE2L2MEN1KMT2A
SCHEMBL16922632 0.87 MAPT (0.33) PTGESALOX5KEAP1NFE2L2MEN1
SCHEMBL13242017 0.87 MAPT (0.34) PTGESALOX5NFE2L2ALDH1A1LMNA
SCHEMBL5036465 0.87 MAPT (0.34) PTGESALOX5NFE2L2ALDH1A1LMNA
SCHEMBL4376815 0.85 MAPT (0.36) PTGESALOX5KEAP1NFE2L2ALDH1A1
SCHEMBL24301561 0.83 CES2 (0.33) PTGESALOX5KEAP1NFE2L2MEN1
SCHEMBL13580061 0.83 MEN1 (0.34) NFE2L2MEN1KMT2ACYP3A4CYP2C19
SCHEMBL15076289 0.83 MEN1 (0.32) PTGESALOX5KEAP1NFE2L2MEN1
SCHEMBL18052487 0.82 SMN1; SMN2 (0.33) NFE2L2MEN1KMT2AALDH1A1HTT
SCHEMBL13242015 0.82 CES2 (0.33) PTGESALOX5MEN1KMT2ACYP3A4

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-9964868-B2 Electrophotographic photoreceptor, electrophotographic photoreceptor cartridge, and image forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2018-05-08 US disclosed
US-20170235240-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2017-08-17 US disclosed