SCHEMBL25084688

SCHEMBL25084688

Cc1nc(-c2n[nH]cc2-c2ccc3ncc(-c4ncn5c4CNCC5)cc3n2)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 8/20 0.36
▸ MAPK14 Q16539 3/20 0.33
▸ TGFBR2 P37173 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CDK6 Q00534 1/20 0.31

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
SCHEMBL25084506 0.88 TGFBR1 (0.37) TGFBR1MAPK14TGFBR2PIM1CDK6
SCHEMBL30156157 0.88 TGFBR1 (0.40) TGFBR1MAPK14TGFBR2PIM1
SCHEMBL25084648 0.88 TGFBR1 (0.40) TGFBR1MAPK14TGFBR2PIM1
SCHEMBL22075114 0.87 FGFR3 (0.33) —
SCHEMBL25084512 0.87 TGFBR1 (0.39) TGFBR1MAPK14TGFBR2
SCHEMBL30156153 0.87 TGFBR1 (0.39) TGFBR1MAPK14TGFBR2
SCHEMBL30156460 0.86 TGFBR1 (0.36) TGFBR1MAPK14PIM1CDK6
SCHEMBL25085115 0.85 PDCD1 (0.38) TGFBR1MAPK14TGFBR2PIM1CDK6
SCHEMBL22074859 0.85 — —
SCHEMBL25084611 0.84 TGFBR1 (0.35) TGFBR1MAPK14

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-11590116-B2 Substituted pyridines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-02-28 — — US disclosed
US-11590116-B2 Substituted pyridines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-02-28 — — 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-11590116-B2 Substituted pyridines and methods of use ALK, ACVR1, ACVR2A TGFBR1 211/4885MAPK14 1504/4885TGFBR2 290/4885

“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.

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