SCHEMBL8347154

SCHEMBL8347154

CC(C)c1cnc(-c2cc(Cl)ccc2F)nc1Nc1ccncc1C(N)=O

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 18/20 0.70
ACVR1B P36896 11/20 0.56
ACVRL1 P37023 10/20 0.56
ACVR1 Q04771 3/20 0.56
BMPR1A P36894 1/20 0.56
BUB1 O43683 1/20 0.46
NUDT1 P36639 1/20 0.45

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
SCHEMBL8344433 0.91 TGFBR1 (0.70) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL8344324 0.90 TGFBR1 (0.71) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL5954510 0.88 TGFBR1 (0.59) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL5954651 0.88 TGFBR1 (0.56) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL5954799 0.87 TGFBR1 (0.57) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL8347945 0.86 BUB1 (0.58) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL5955195 0.86 TGFBR1 (0.62) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL8348958 0.86 TGFBR1 (0.63) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL16110716 0.86 TGFBR1 (0.73) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL8344363 0.86 TGFBR1 (0.63) TGFBR1ACVR1BACVRL1ACVR1BMPR1A

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