SCHEMBL1629892

SCHEMBL1629892

[C-]#[N+]c1ccc(C=Cc2ccc(C#N)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.47
ALDH1A1 P00352 5/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
HDAC2 Q92769 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
P4HB P07237 1/20 0.41
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
NR1H3 Q13133 1/20 0.40
HTT P42858 1/20 0.38
CYP2A6 P11509 1/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA6 P23280 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL1630803 1.00 FBP1 (0.47) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL10031895 0.89 MAOB (0.50) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL10031860 0.89 PARP15 (0.42) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL324969 0.89 CA2 (0.46) FBP1ALDH1A1CYP2A6CA12CA2
SCHEMBL1630806 0.87 ALDH1A1 (0.41) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL10031939 0.87 KIF11 (0.42) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL10031938 0.87 KDM4E (0.40) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL10031956 0.87 FBP1 (0.38) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL11966166 0.84 MAPT (0.53) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL12230308 0.84 FBP1 (0.39) FBP1ALDH1A1MAPTLMNAHDAC2

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