SCHEMBL18680245

SCHEMBL18680245

COc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/C=C/c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 2/20 0.67
ACHE P22303 1/20 0.52
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
TP53 P04637 2/20 0.48
CYP3A4 P08684 2/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ALOX5 P09917 2/20 0.48
TRPA1 O75762 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
TUBB1 Q9H4B7 2/20 0.46
ESR1 P03372 2/20 0.46
CYP1A2 P05177 2/20 0.46
ABL1 P00519 1/20 0.46
TTR P02766 1/20 0.46

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
SCHEMBL18680257 1.00 RELA (0.67) RELAACHEMAOAMAOBTP53
SCHEMBL8943803 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL7904561 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL4400838 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL16489738 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL10015741 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL1366377 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL7904563 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL7870286 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53
SCHEMBL12576222 0.93 RELA (0.78) RELAACHEMAOAMAOBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9977354-B2 Coating liquid for electrophotographic photoreceptor production, electrophotographic photoreceptor, and image formation apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2018-05-22 US disclosed
US-9977354-B2 Coating liquid for electrophotographic photoreceptor production, electrophotographic photoreceptor, and image formation apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2018-05-22 US disclosed
US-20170090308-A1 COATING LIQUID FOR ELECTROPHOTOGRAPHIC PHOTORECEPTOR PRODUCTION, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, AND IMAGE FORMATION APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-30 US disclosed
US-20170090308-A1 COATING LIQUID FOR ELECTROPHOTOGRAPHIC PHOTORECEPTOR PRODUCTION, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, AND IMAGE FORMATION APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-30 US disclosed