SCHEMBL3604895

SCHEMBL3604895

Cn1c(-c2ccc3nccnc3c2)c(-c2cccc(CNS(C)(=O)=O)c2)c(=O)n1C

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.72

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
SCHEMBL3608993 0.90 TGFBR1 (0.64) TGFBR1
SCHEMBL373352 0.84 TGFBR1 (1.00) TGFBR1
SCHEMBL373305 0.83 TGFBR1 (1.00) TGFBR1
SCHEMBL373685 0.83 TGFBR1 (0.81) TGFBR1
SCHEMBL373143 0.82 TGFBR1 (1.00) TGFBR1
SCHEMBL373414 0.81 TGFBR1 (1.00) TGFBR1
SCHEMBL3596529 0.81 TGFBR1 (0.78) TGFBR1
SCHEMBL3599806 0.81 TGFBR1 (0.72) TGFBR1
SCHEMBL3603161 0.81 TGFBR1 (0.78) TGFBR1
SCHEMBL372655 0.81 TGFBR1 (1.00) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056505-A1 Substituted Pyrazalones BIOGEN IDEC MA INC. 2010-03-04 US claimed
EP-1971594-A2 SUBSTITUTED PYRAZALONES Biogen Idec MA Inc. (US) 2008-09-24 EP claimed
WO-2007059359-A2 SUBSTITUTED PYRAZALONES BIOGEN IDEC MA INC. (US) 2007-05-24 WO claimed

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-20100056505-A1 Substituted Pyrazalones ACVR1, ACVRL1, TGFBR1 TGFBR1 3/4885

“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.