SCHEMBL1497073

SCHEMBL1497073

CN(C)CCC(NC(=O)NCc1ccc(F)cc1)c1ccc(C(=O)Nc2cscc2N)nc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 7/20 0.47
HDAC3 O15379 6/20 0.38
HDAC1 Q13547 5/20 0.38
HDAC2 Q92769 5/20 0.38
NCOR2 Q9Y618 5/20 0.38
NCOR1 O75376 1/20 0.37
MAPK1 P28482 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
ANPEP P15144 1/20 0.34

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
SCHEMBL1497037 0.92 UTS2R (0.38) UTS2RHDAC3HDAC1HDAC2NCOR2
SCHEMBL1496897 0.91 UTS2R (0.47) UTS2RHDAC3HDAC1HDAC2NCOR2
SCHEMBL1497059 0.90 UTS2R (0.47) UTS2RHDAC3HDAC1HDAC2NCOR2
Hydrochloric Acid SCHEMBL1496948 0.90 UTS2R (0.47) UTS2R
SCHEMBL1496973 0.89 UTS2R (0.47) UTS2RHDAC3HDAC1HDAC2NCOR2
SCHEMBL1496910 0.87 UTS2R (0.41) UTS2R
SCHEMBL1497075 0.87 UTS2R (0.44) UTS2RHDAC1MAPK1TSHRMEN1
Hydrochloric Acid SCHEMBL1497060 0.86 UTS2R (0.47) UTS2RHDAC1KMT2A
SCHEMBL1497044 0.85 UTS2R (0.45) UTS2RKMT2A
SCHEMBL1497187 0.85 UTS2R (0.42) UTS2R

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-2292611-B1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2012-07-25 EP disclosed
EP-2292611-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2011-03-09 EP disclosed