SCHEMBL25084690

SCHEMBL25084690

Cc1cccc(-c2n[nH]cc2-c2ccc3ncc(CO)cc3n2)n1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 19/20 0.40
▸ MAPK14 Q16539 3/20 0.34
▸ METAP2 P50579 1/20 0.33
▸ RIPK2 O43353 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ ACVR1B P36896 1/20 0.33

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
SCHEMBL30156163 1.00 TGFBR1 (0.40) TGFBR1MAPK14METAP2RIPK2KDR
SCHEMBL25084828 0.86 TGFBR1 (0.43) TGFBR1
SCHEMBL30156560 0.86 TGFBR1 (0.43) TGFBR1
SCHEMBL30156054 0.86 TGFBR1 (0.42) TGFBR1MAPK14METAP2
SCHEMBL25084996 0.86 TGFBR1 (0.42) TGFBR1MAPK14METAP2
SCHEMBL25822564 0.85 TGFBR1 (0.44) TGFBR1MAPK14METAP2
SCHEMBL25084824 0.84 TGFBR1 (0.41) TGFBR1
SCHEMBL30156591 0.84 TGFBR1 (0.41) TGFBR1
SCHEMBL23418587 0.84 TGFBR1 (0.42) TGFBR1MAPK14METAP2
SCHEMBL25084697 0.84 TGFBR1 (0.42) TGFBR1MAPK14METAP2

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-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 1504/4885METAP2 1827/4885

“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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