SCHEMBL7192071

SCHEMBL7192071

Nc1ccc(C(=O)c2ccc(N)c(Cl)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
POLB P06746 1/20 0.58
CYP3A4 P08684 3/20 0.53
TSHR P16473 3/20 0.53
ALOX15 P16050 2/20 0.53
HPGD P15428 2/20 0.53
THRB P10828 1/20 0.53
CASP1 P29466 1/20 0.53
RECQL P46063 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SRD5A2 P31213 1/20 0.52
PBRM1 Q86U86 1/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
MAPK1 P28482 2/20 0.42
HTT P42858 2/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL437529 0.92 ALDH1A1 (0.66) ALDH1A1POLBCYP3A4TSHRALOX15
SCHEMBL4608673 0.87 ALDH1A1 (0.71) ALDH1A1POLBALOX15SRD5A2PBRM1
SCHEMBL7190124 0.84 PBRM1 (0.62) ALDH1A1POLBCYP3A4TSHRALOX15
SCHEMBL7194683 0.82 ALDH1A1 (0.53) ALDH1A1POLBCYP3A4TSHRALOX15
SCHEMBL7189678 0.82 ALDH1A1 (0.60) ALDH1A1POLBCYP3A4TSHRALOX15
SCHEMBL1898829 0.82 LMNA (0.50) ALDH1A1POLBHPGDTHRBRECQL
SCHEMBL9097535 0.78 CA12 (0.59) ALDH1A1POLBCYP3A4HPGDSRD5A2
SCHEMBL62657 0.78 CA12 (0.59) ALDH1A1POLBCYP3A4HPGDSRD5A2
SCHEMBL204877 0.78 CA12 (0.59) ALDH1A1POLBCYP3A4HPGDSRD5A2
SCHEMBL1469205 0.78 ALDH1A1 (0.54) ALDH1A1POLBCYP3A4TSHRALOX15

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
US-20030064235-A1 Optical members made of polymide resins MITSUI CHEMICALS, INC. (JP) 2003-04-03 US disclosed
EP-1237015-A1 OPTICAL MEMBERS MADE OF POLYIMIDE RESINS Mitsui Chemicals, Inc. (JP) 2002-09-04 EP disclosed