SCHEMBL21174178

SCHEMBL21174178

Cn1cc(-c2cc(F)cc(CNC(=O)c3ncnc4nc(C5CCOCC5)[nH]c34)c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 4/20 0.47
▸ MAPK1 P28482 5/20 0.39
▸ KAT5 Q92993 1/20 0.38
▸ EZH2 Q15910 1/20 0.38
▸ BTK Q06187 3/20 0.36
▸ KIT P10721 1/20 0.36
▸ WNT1 P04628 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ PIK3CD O00329 3/20 0.35
▸ CHRM1 P11229 1/20 0.35

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
SCHEMBL21174259 0.95 MET (0.46) METMAPK1KAT5EZH2BTK
SCHEMBL21174281 0.95 MET (0.50) METMAPK1BTKKIT
SCHEMBL21174231 0.94 MET (0.49) METMAPK1EZH2BTKKIT
SCHEMBL21174064 0.94 MET (0.49) METMAPK1EZH2BTKKIT
SCHEMBL21174449 0.92 MET (0.45) METMAPK1EZH2BTKKIT
SCHEMBL30751108 0.92 MET (0.47) METMAPK1BTKKITWNT1
SCHEMBL27376365 0.92 MET (0.47) METMAPK1BTKKITWNT1
SCHEMBL27376359 0.92 MET (0.47) METMAPK1EZH2BTKKIT
SCHEMBL30751474 0.92 MET (0.47) METMAPK1EZH2BTKKIT
Hydrochloric Acid SCHEMBL30751296 0.91 MET (0.47) METMAPK1EZH2BTKKIT

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 8 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
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
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 383/4885KAT5 505/4885
US-10774083-B2 Heterocyclic amide compound PRSS8, PRSS1, PRSS2 MET 4152/4885MAPK1 383/4885KAT5 505/4885

“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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