SCHEMBL25084971

SCHEMBL25084971

CNCCn1cc(-c2cnc3ccc(-c4c[nH]nc4-c4ccc(F)c(C)n4)cc3c2)cn1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 5/20 0.38
▸ MET P08581 9/20 0.37
▸ FGFR1 P11362 3/20 0.36
▸ FGFR3 P22607 3/20 0.36
▸ KDR P35968 3/20 0.36
▸ FGFR2 P21802 2/20 0.36
▸ FGFR4 P22455 2/20 0.36
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ ALK Q9UM73 2/20 0.34
▸ MAPK14 Q16539 1/20 0.34

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
SCHEMBL25084833 0.90 FGFR1 (0.41) TGFBR1METFGFR1FGFR3KDR
SCHEMBL25084931 0.87 TGFBR1 (0.41) TGFBR1METFGFR1FGFR3KDR
SCHEMBL30156028 0.87 TGFBR1 (0.41) TGFBR1METFGFR1FGFR3KDR
SCHEMBL22074842 0.86 FGFR1 (0.37) TGFBR1METFGFR1FGFR3KDR
SCHEMBL30156049 0.84 MET (0.40) TGFBR1METFGFR1FGFR3KDR
SCHEMBL25085076 0.83 TGFBR1 (0.36) TGFBR1FGFR1FGFR3KDRFGFR2
SCHEMBL25084628 0.81 TGFBR1 (0.41) TGFBR1METFGFR1FGFR3KDR
SCHEMBL22075109 0.81 FGFR1 (0.41) METFGFR1FGFR3KDRFGFR2
SCHEMBL30579102 0.81 FGFR1 (0.41) METFGFR1FGFR3KDRFGFR2
SCHEMBL25084906 0.80 TGFBR1 (0.48) TGFBR1METFGFR1FGFR3FGFR2

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 211/4885MET 82/4885FGFR1 123/4885

“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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