SCHEMBL6436940

SCHEMBL6436940

CC(NC(=O)NCc1ccccc1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.68
CASR P41180 1/20 0.65
MAPT P10636 2/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
ANPEP P15144 3/20 0.58
HSD17B10 Q99714 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
ALDH1A1 P00352 1/20 0.57
ATM Q13315 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
OPRM1 P35372 1/20 0.53
OPRD1 P41143 1/20 0.53
OPRK1 P41145 1/20 0.53

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
SCHEMBL19570381 0.90 UTS2R (0.64) EPHX2CASRMAPTL3MBTL1ANPEP
SCHEMBL2408076 0.86 HDAC6 (0.62) EPHX2MAPTL3MBTL1ANPEPALDH1A1
SCHEMBL12252067 0.84 MAPT (0.69) MAPTL3MBTL1ANPEPMEN1KMT2A
SCHEMBL10154589 0.83 CASR (0.69) EPHX2CASRMAPTHSD17B10MEN1
SCHEMBL6438516 0.83 CNR2 (0.59) EPHX2MAPTL3MBTL1ANPEPCYP3A4
SCHEMBL16321397 0.82 EPHX2 (0.49) EPHX2CASRMAPTL3MBTL1ANPEP
SCHEMBL16321396 0.82 EPHX2 (0.49) EPHX2CASRMAPTL3MBTL1ANPEP
SCHEMBL29025899 0.82 EPHX2 (0.49) EPHX2CASRMAPTL3MBTL1ANPEP
SCHEMBL16321395 0.82 EPHX2 (0.49) EPHX2CASRMAPTL3MBTL1ANPEP
SCHEMBL16321398 0.82 EPHX2 (0.49) EPHX2CASRMAPTL3MBTL1ANPEP

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
CN-103664704-B A kind of synthetic N, the method for N '-disubstituted urea NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-05-18 CN disclosed
CN-103664704-A Method for synthesizing N,N'-disubstituent urea UNIV NANJING SCIENCE & TECH 2014-03-26 CN disclosed
US-20050077648-A1 Solution casting method and polymer film FUJIFILM CORPORATION (JP) 2005-04-14 US disclosed