SCHEMBL14564465

SCHEMBL14564465

COC(=O)c1cnccc1Nc1nc(-c2cc(Cl)ccc2F)nc2nc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)ccc12

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 13/20 0.45
ACVR1B P36896 9/20 0.44
ACVRL1 P37023 9/20 0.44
BUB1 O43683 4/20 0.38
CSNK2A1 P68400 1/20 0.37
LMNA P02545 1/20 0.36
ACVR1 Q04771 2/20 0.36
NUDT1 P36639 1/20 0.36
BMPR1B O00238 1/20 0.36
BMPR1A P36894 1/20 0.36

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
SCHEMBL14564464 0.94 TGFBR1 (0.43) TGFBR1ACVR1BACVRL1ACVR1NUDT1
SCHEMBL2212676 0.93 NUDT1 (0.46) TGFBR1ACVR1BACVRL1BUB1ACVR1
SCHEMBL12213373 0.86 BUB1 (0.40) TGFBR1ACVR1BACVRL1BUB1NUDT1
SCHEMBL14576083 0.85 BUB1 (0.39) TGFBR1ACVR1BACVRL1BUB1NUDT1
SCHEMBL12510856 0.80 TGFBR1 (0.44) TGFBR1ACVR1BACVRL1BUB1ACVR1
SCHEMBL14564463 0.79 TGFBR1 (0.45) TGFBR1ACVR1BACVRL1BUB1ACVR1
SCHEMBL14564461 0.79 TGFBR1 (0.56) TGFBR1ACVR1BACVRL1BUB1CSNK2A1
SCHEMBL2211654 0.79 TGFBR1 (0.47) TGFBR1ACVR1BACVRL1BUB1CSNK2A1
SCHEMBL2492437 0.77 TGFBR1 (0.48) TGFBR1ACVR1BACVRL1NUDT1
SCHEMBL8346247 0.74 TGFBR1 (0.59) TGFBR1ACVR1BACVRL1BUB1ACVR1

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
US-20070066632-A1 Fused bicyclic inhibitors of TGFbeta SCIOS, INC. (US) 2007-03-22 US disclosed
US-20070066632-A1 Fused bicyclic inhibitors of TGFbeta SCIOS, INC. (US) 2007-03-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070066632-A1 Fused bicyclic inhibitors of TGFbeta TGFBR1, TGFB1, SMAD2 TGFBR1 1/4885ACVR1B 11/4885ACVRL1 25/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.