SCHEMBL21174367

SCHEMBL21174367

Cn1cc(-c2cc(F)cc(CNC(=O)c3nccc4nc(C5CCC(F)C5)[nH]c34)c2)cn1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 4/20 0.44
▸ MAPK1 P28482 1/20 0.36
▸ BTK Q06187 9/20 0.36
▸ KIT P10721 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ROS1 P08922 1/20 0.35
▸ ALK Q9UM73 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ CLK1 P49759 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
SCHEMBL21174128 0.92 MET (0.47) METMAPK1BTKKITSMN1; SMN2
SCHEMBL21174244 0.90 EGLN2 (0.37) METBTKKITAURKB
SCHEMBL21174084 0.88 MET (0.43) METMAPK1BTKAURKB
SCHEMBL21174248 0.87 MET (0.43) METMAPK1BTKKITROS1
SCHEMBL21174158 0.83 MET (0.46) METMAPK1BTKKITSMN1; SMN2
SCHEMBL21174256 0.82 MET (0.48) METMAPK1BTKKITSMN1; SMN2
SCHEMBL21174285 0.82 MET (0.45) METMAPK1BTKKITSMN1; SMN2
SCHEMBL27376668 0.81 MET (0.36) METMAPK1BTK
SCHEMBL21174407 0.81 BTK (0.46) METMAPK1BTKAURKBCLK1
SCHEMBL21174281 0.81 MET (0.50) METMAPK1BTKKITSMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3514149-B1 HETEROCYCLIC AMIDE COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2022-05-18 — — EP disclosed
US-10774083-B2 Heterocyclic amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-09-15 — — US disclosed
US-10774083-B2 Heterocyclic amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-09-15 — — US disclosed
US-20190241566-A1 HETEROCYCLIC AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 — — US disclosed
US-20190241566-A1 HETEROCYCLIC AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 — — US disclosed
EP-3514149-A1 HETEROCYCLIC AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2019-07-24 — — EP 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 (2 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-20190241566-A1 HETEROCYCLIC AMIDE COMPOUND PRSS8, PRSS1, PRSS2 MET 4152/4885MAPK1 383/4885BTK 3904/4885
US-10774083-B2 Heterocyclic amide compound PRSS8, PRSS1, PRSS2 MET 4152/4885MAPK1 383/4885BTK 3904/4885

“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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