SCHEMBL1628449

SCHEMBL1628449

[C-]#[N+]c1ccc(C=Cc2cccc3ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHAT P28329 5/20 0.57
PTGS1 P23219 1/20 0.50
PTGS2 P35354 1/20 0.50
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA7 P36544 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
SCHEMBL1628770 0.88 NFE2L2 (0.44) CHAT
SCHEMBL9168728 0.87 CHAT (0.70) CHATPTGS1PTGS2
SCHEMBL9168725 0.87 CHAT (0.70) CHATPTGS1PTGS2
SCHEMBL1629888 0.83 NFE2L2 (0.45) CHAT
SCHEMBL1629917 0.82 KDM4E (0.44) CHAT
SCHEMBL1782982 0.81 CHAT (0.68) CHATPTGS1PTGS2
SCHEMBL29794070 0.81 CHAT (0.68) CHATPTGS1PTGS2
Benzene SCHEMBL28841289 0.81 CHAT (0.68) CHATPTGS1PTGS2
SCHEMBL2774767 0.81 CHAT (0.68) CHATPTGS1PTGS2
SCHEMBL6051064 0.81 CHAT (0.68) CHATPTGS1PTGS2

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-8835084-B2 Electrophotographic photoreceptor, and image forming method, image forming apparatus and process cartridge using same RICOH COMPANY, LTD. (JP) 2014-09-16 US disclosed
US-20120087695-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, AND IMAGE FORMING METHOD, IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE USING SAME RICOH COMPANY, LTD. (JP) 2012-04-12 US disclosed