SCHEMBL2474633

SCHEMBL2474633

CN(C)CCCC(NC(=O)Nc1ccc2c(c1)CCC2)c1ccc(C(=O)Nc2ccccc2N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 6/20 0.45
NPC1 O15118 7/20 0.44
RAB9A P51151 7/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
MAPK14 Q16539 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HDAC1 Q13547 6/20 0.42
HDAC3 O15379 3/20 0.41
HDAC2 Q92769 3/20 0.41
NCOR2 Q9Y618 3/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41

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
SCHEMBL2474635 0.95 UTS2R (0.50) UTS2RNPC1RAB9ANFKB1NFKB2
SCHEMBL2472852 0.90 NPC1 (0.47) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL4227992 0.89 HDAC3 (0.42) UTS2RNPC1RAB9ANFKB1NFKB2
SCHEMBL2476312 0.89 NPC1 (0.49) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL3834611 0.89 KMT2A (0.48) UTS2RNPC1RAB9ANFKB1NFKB2
SCHEMBL3836235 0.88 NPC1 (0.48) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL4388403 0.87 NPC1 (0.47) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL2478122 0.87 UTS2R (0.42) UTS2RNPC1RAB9ANFKB1NFKB2
SCHEMBL2476829 0.86 UTS2R (0.49) UTS2RSMN1; SMN2MAPTHDAC1HDAC3
SCHEMBL2478981 0.85 NPC1 (0.42) NPC1RAB9ANFKB1NFKB2RELA

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
EP-2107052-B1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2011-10-12 EP disclosed
EP-2107052-A1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2009-10-07 EP disclosed