SCHEMBL10068360

SCHEMBL10068360

CCCc1ccc(N(c2ccc(C)cc2)c2ccc(C=O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.53
ALDH1A1 P00352 2/20 0.50
ALDH3A1 P30838 1/20 0.50
ALDH1A3 P47895 1/20 0.50
CYP2A13 Q16696 1/20 0.44
CNR2 P34972 2/20 0.41
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CYP1A2 P05177 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL17311349 0.95 CYP2A6 (0.48) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL806277 0.88 CYP2A6 (0.59) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL10023974 0.87 ALDH1A1 (0.50) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL339173 0.86 CYP2A6 (0.73) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL13158692 0.86 CYP2A6 (0.73) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL13158697 0.86 CYP2A6 (0.73) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL973801 0.86 LPL (0.48) CYP2A6ALDH1A1CNR2ESR1ESR2
SCHEMBL3340810 0.86 CYP2A6 (0.73) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13
SCHEMBL14981808 0.86 LPL (0.48) CYP2A6ALDH1A1CNR2ESR1ESR2
SCHEMBL11887475 0.85 ALDH1A1 (0.49) CYP2A6ALDH1A1ALDH3A1ALDH1A3CYP2A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673523-B2 Image holding member for image forming apparatus, process cartridge, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-03-18 US disclosed
US-8664645-B2 Organic electroluminescence element and display medium FUJI XEROX CO., LTD. (JP) 2014-03-04 US disclosed
US-8475981-B2 Image holding member for image forming apparatus, process cartridge, and image forming apparatus FUJI XEROX, CO., LTD. (JP) 2013-07-02 US disclosed
US-20120187384-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND DISPLAY MEDIUM FUJI XEROX CO., LTD. (JP) 2012-07-26 US disclosed
US-20120015290-A1 IMAGE HOLDING MEMBER FOR IMAGE FORMING APPARATUS, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2012-01-19 US disclosed
US-20110207040-A1 IMAGE HOLDING MEMBER FOR IMAGE FORMING APPARATUS, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2011-08-25 US disclosed