SCHEMBL21363939

SCHEMBL21363939

Cc1nc(-c2ncccc2-c2ccc3ncc(C)n3c2)ccc1F

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.76
TGFBR2 P37173 3/20 0.73

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
SCHEMBL29833492 0.86 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005132 0.86 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005138 0.85 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833422 0.85 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL15639320 0.82 TGFBR1 (0.53) TGFBR1TGFBR2
SCHEMBL15638289 0.80 TGFBR1 (0.51) TGFBR1TGFBR2
SCHEMBL15639470 0.80 TGFBR1 (0.51) TGFBR1TGFBR2
SCHEMBL15638759 0.77 TGFBR1 (0.48) TGFBR1TGFBR2
SCHEMBL18069412 0.77 TGFBR1 (0.85) TGFBR1TGFBR2
SCHEMBL29833412 0.77 TGFBR1 (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2019-09-19 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-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use TGFBR2, ACVR1, TGFBR1 TGFBR1 3/4885TGFBR2 1/4885

“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.