SCHEMBL7440779

SCHEMBL7440779

Cc1cc(N(C)c2ccc(-n3cccc3-c3nnn[nH]3)cc2)n2c(C(=O)O)ncc2n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.31

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
SCHEMBL7440189 0.90
SCHEMBL7434477 0.82 TGFBR1 (0.35) TGFBR1
SCHEMBL7440798 0.81 AGTR1 (0.32) TGFBR1
SCHEMBL7449367 0.79
SCHEMBL7445460 0.78 DPP4 (0.39)
SCHEMBL7440095 0.76 TSHR (0.30)
SCHEMBL7440011 0.73 AGTR1 (0.34)
SCHEMBL7440210 0.73 AGTR1 (0.32)
SCHEMBL7442759 0.72 AGTR1 (0.33)
SCHEMBL7438553 0.70 BRD4 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628559-B1 Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF LILLY GMBH (DE) 2002-04-03 EP disclosed
US-5602137-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5602136-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5571813-A Fused pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1996-11-05 US disclosed
EP-0628559-A1 Pyrimidine compounds and their use as pharmaceuticals Beiersdorf-Lilly GmbH (DE) 1994-12-14 EP disclosed