SCHEMBL13891762

SCHEMBL13891762

C=C(C)C(=O)Cc1ccc(-c2ccc(N(c3ccccc3)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CNR2 P34972 2/20 0.44
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
LMNA P02545 2/20 0.41
ABCC4 O15439 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
PTGS1 P23219 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
CNR1 P21554 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.38
CYP3A4 P08684 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
SCHEMBL13891757 0.90 RAB9A (0.41) MEN1KMT2ALMNAABCC4GAA
SCHEMBL16639873 0.87 PLAAT3 (0.47) MEN1KMT2ACNR2PTGESALOX5
SCHEMBL9915790 0.86 L3MBTL1 (0.42) KMT2ACNR2LMNAGAATDP1
SCHEMBL13891747 0.81 ITGB1 (0.35) MEN1KMT2ACNR2PTGESALOX5
SCHEMBL15910228 0.81 MMP12 (0.43) MEN1KMT2APTGESALOX5LMNA
SCHEMBL24565043 0.81 CTBP2 (0.47) MEN1KMT2ALMNAGAATDP1
SCHEMBL9607495 0.79 ABCC4 (0.56) MEN1KMT2ACNR2LMNAABCC4
SCHEMBL279137 0.79 ABCC4 (0.56) MEN1KMT2ACNR2LMNAABCC4
SCHEMBL12395736 0.79 ALDH1A1 (0.42) KMT2AALOX5LMNAGAATSHR
SCHEMBL15403037 0.79 LMNA (0.47) MEN1KMT2ALMNAABCC4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517625-B2 Electrophotographic photoreceptor with improved durability and wear resistance; high quality latent images; crosslinked charge transport layer has a hardened monomer having three or more functional groups without charge transport structure and one with charge transport-containing (meth)acryloyloxy groups RICOH COMPANY, LTD. (JP) 2009-04-14 US disclosed