SCHEMBL8347402

SCHEMBL8347402

CNC(=O)c1cnccc1Nc1nc(-c2cc(Cl)ccc2F)ncc1OC

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 9/20 0.59
NUDT1 P36639 2/20 0.58
TGFBR1 P36897 9/20 0.55
ACVRL1 P37023 6/20 0.55
ACVR1B P36896 5/20 0.55
ACVR1 Q04771 1/20 0.46

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
SCHEMBL8346014 0.91 TGFBR1 (0.56) BUB1NUDT1TGFBR1ACVRL1ACVR1B
SCHEMBL8346247 0.91 TGFBR1 (0.59) BUB1NUDT1TGFBR1ACVRL1ACVR1B
SCHEMBL5955139 0.90 TGFBR1 (0.56) BUB1NUDT1TGFBR1ACVRL1ACVR1B
SCHEMBL8347945 0.90 BUB1 (0.58) BUB1NUDT1TGFBR1ACVRL1ACVR1B
SCHEMBL8346119 0.90 TGFBR1 (0.57) BUB1NUDT1TGFBR1ACVRL1ACVR1B
SCHEMBL5955532 0.90 TGFBR1 (0.59) BUB1TGFBR1ACVRL1ACVR1BACVR1
SCHEMBL5954795 0.89 TGFBR1 (0.58) BUB1TGFBR1ACVRL1ACVR1BACVR1
SCHEMBL5954715 0.89 TGFBR1 (0.58) BUB1TGFBR1ACVRL1ACVR1BACVR1
SCHEMBL5954828 0.89 TGFBR1 (0.60) BUB1TGFBR1ACVRL1ACVR1BACVR1
SCHEMBL3827835 0.89 TGFBR1 (0.59) BUB1NUDT1TGFBR1ACVRL1ACVR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004024159-A1 INHIBITORS OF TFGβ SCIOS INC. (US) 2004-03-25 WO disclosed