SCHEMBL14727236

SCHEMBL14727236

CCCCc1ccc(N(c2ccc(/C=C/c3ccc(C)c(C)c3)cc2)c2cccc(N(c3ccc(/C=C/c4ccc(C)c(C)c4)cc3)c3ccc(CCCC)cc3)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 3/20 0.40
CYP2C9 P11712 3/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
CYP4Z1 Q86W10 1/20 0.38
CYP4F11 Q9HBI6 1/20 0.38
CYP4F12 Q9HCS2 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
SKP2 Q13309 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PTAFR P25105 1/20 0.34
TUBB1 Q9H4B7 3/20 0.34
KDM4A O75164 2/20 0.34
KDM2A Q9Y2K7 2/20 0.34

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
SCHEMBL11887110 0.82 SKP2 (0.47) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL12593387 0.82 SKP2 (0.47) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL5061273 0.82 SKP2 (0.47) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL7718254 0.82 CYP3A4 (0.49) CYP3A4CYP2D6CYP2C9SPHK1TRPV1
SCHEMBL9915627 0.82 CYP3A4 (0.49) CYP3A4CYP2D6CYP2C9SPHK1TRPV1
SCHEMBL16922616 0.81 CYP3A4 (0.38) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL4862718 0.80 CYP3A4 (0.36) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL4862712 0.80 CYP3A4 (0.36) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL14200071 0.79 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL9236703 0.79 CNR2 (0.46) SKP2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11287756-B2 Positive charging electrophotographic photoreceptor, electrophotographic cartridge and image forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-29 US disclosed
US-8709689-B2 Electrophotographic photoreceptor, image-forming apparatus, and electrophotographic cartridge MITSUBISHI CHEMICAL CORPORATION (JP) 2014-04-29 US disclosed
US-20130052574-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE-FORMING APPARATUS, AND ELECTROPHOTOGRAPHIC CARTRIDGE MITSUBISHI CHEMICAL CORPORATION (JP) 2013-02-28 US disclosed