SCHEMBL21380650

SCHEMBL21380650

NC(=O)c1cnc2ccc(-c3c[nH]nc3-c3cccc(C(F)F)n3)cn12

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.74
TGFBR2 P37173 5/20 0.56

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
SCHEMBL19806296 0.85 TGFBR1 (0.74) TGFBR1TGFBR2
SCHEMBL18005149 0.85 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833418 0.85 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005219 0.83 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833433 0.83 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL18005139 0.83 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL29833448 0.83 TGFBR1 (1.00) TGFBR1TGFBR2
SCHEMBL19806557 0.81 TGFBR1 (0.73) TGFBR1
SCHEMBL21380696 0.79 TGFBR1 (0.59) TGFBR1TGFBR2
SCHEMBL20379841 0.78 TGFBR1 (0.81) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2019-09-26 US disclosed
US-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2019-09-26 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-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS TGFBR1, TGFBR2, TGFB1 TGFBR1 1/4885TGFBR2 2/4885

“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.