SCHEMBL7512153

SCHEMBL7512153

CC(C)C(N(C)C)n1cc(-c2cncc(-c3cccc(Cl)c3)c2)c2cc(C#N)ccc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 6/20 0.35
FNTB P49356 6/20 0.35
PGGT1B P53609 3/20 0.34
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33

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
SCHEMBL7508656 0.90 PGR (0.37) FNTAFNTBNR3C1PGRNR3C2
SCHEMBL7516392 0.90 KDR (0.36) FNTAFNTBPGGT1BNR3C1PGR
SCHEMBL7507024 0.88 KDM1A (0.39) FNTAFNTBPGGT1B
SCHEMBL7503782 0.83 KDR (0.41) FNTAFNTBPGGT1B
SCHEMBL7504857 0.83 KDR (0.48) NR3C1PGRNR3C2
SCHEMBL7511432 0.83 KDM1A (0.44) FNTAFNTBNR3C1PGRNR3C2
SCHEMBL7975983 0.79 CCNT1 (0.36) FNTAFNTB
SCHEMBL7507970 0.78 KDR (0.52) FNTAFNTB
SCHEMBL7994139 0.77 KDR (0.41) FNTAFNTBPGGT1B
SCHEMBL7549609 0.73 KDR (0.49)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147107-A4 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO INC (US) 2002-05-22 EP claimed
EP-1147107-A1 NOVEL ANGIOGENESIS INHIBITORS Merck & Co., Inc. (US) 2001-10-24 EP claimed
WO-2000043393-A1 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO., INC. (US) 2000-07-27 WO claimed
EP-1147107-A4 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO INC (US) 2002-05-22 EP disclosed
EP-1147107-A1 NOVEL ANGIOGENESIS INHIBITORS Merck & Co., Inc. (US) 2001-10-24 EP disclosed
US-6265403-B1 TYROSINE INHIBITORS MERCK & CO., INC. 2001-07-24 US disclosed
WO-2000043393-A1 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO., INC. (US) 2000-07-27 WO disclosed