SCHEMBL2476432

SCHEMBL2476432

CN(C)CCCC(NC(=O)NCc1ccco1)c1ccc(C(=O)Nc2ccccc2N)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 5/20 0.46
HDAC1 Q13547 10/20 0.45
EPHX2 P34913 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HDAC3 O15379 4/20 0.41
HDAC2 Q92769 4/20 0.41
NCOR2 Q9Y618 4/20 0.41
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL2473783 0.86 UTS2R (0.42) UTS2RHDAC1EPHX2GAATSHR
SCHEMBL2472961 0.82 HDAC1 (0.55) UTS2RHDAC1EPHX2HDAC3HDAC2
SCHEMBL2475487 0.81 UTS2R (0.65) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL2473259 0.81 UTS2R (0.51) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL2470960 0.80 UTS2R (0.46) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL2478630 0.80 HDAC1 (0.56) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL3832758 0.80 UTS2R (0.49) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL2474066 0.79 HDAC1 (0.62) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL3837712 0.78 UTS2R (0.48) UTS2RHDAC1HDAC3HDAC2NCOR2
SCHEMBL3831092 0.78 UTS2R (0.48) UTS2RHDAC1HDAC3HDAC2NCOR2

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