SCHEMBL18005352

SCHEMBL18005352

CC(=O)Nc1cnc(-c2cccc(C)n2)c(-c2ccc3ncc(C#N)n3c2)c1.CC(=O)Nc1cnc(-c2cccc(C)n2)c(-c2ccc3ncc(C(N)=O)n3c2)c1

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.88
TGFBR2 P37173 4/20 0.86

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
SCHEMBL29833462 0.94 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005210 0.94 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833475 0.93 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005285 0.93 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005384 0.82 TGFBR1 (0.78) TGFBR1TGFBR2
SCHEMBL18005435 0.81 TGFBR1 (0.68) TGFBR1TGFBR2
SCHEMBL20193890 0.80 TGFBR1 (0.75) TGFBR1TGFBR2
SCHEMBL18005128 0.80 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833452 0.80 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005284 0.80 TGFBR1 (0.74) TGFBR1TGFBR2

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-3259264-A1 GDF-8 INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2017-12-27 EP claimed
WO-2016133838-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-08-25 WO claimed