SCHEMBL17548581

SCHEMBL17548581

COc1cncc(Cn2nc(-c3cccc(C(F)(F)F)c3)c3c2CCN(C(C)=O)C3)c1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 19/20 0.70
▸ GRIN1 Q05586 1/20 0.49
▸ GRIN2B Q13224 1/20 0.49

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
SCHEMBL10805998 0.86 KCNK3 (0.81) KCNK3
SCHEMBL14784992 0.86 KCNK3 (0.80) KCNK3
SCHEMBL14784582 0.84 KCNK3 (0.78) KCNK3
SCHEMBL14785369 0.84 KCNK3 (0.83) KCNK3
SCHEMBL14784540 0.84 KCNK3 (0.69) KCNK3
SCHEMBL14785044 0.83 KCNK3 (0.83) KCNK3
SCHEMBL14785042 0.83 KCNK3 (0.69) KCNK3
SCHEMBL14786414 0.82 KCNK3 (1.00) KCNK3
SCHEMBL14784171 0.81 KCNK3 (1.00) KCNK3
SCHEMBL14791479 0.81 KCNK3 (0.82) KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598410-B2 Substituted 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-C]pyridines, their use as medicament, and pharmaceutical preparations comprising them SANOFI (FR) 2017-03-21 — — US disclosed
US-9598410-B2 Substituted 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-C]pyridines, their use as medicament, and pharmaceutical preparations comprising them SANOFI (FR) 2017-03-21 — — US disclosed
US-20160060259-A1 Substituted 4,5,6,7-Tetrahydro-1H-Pyrazolo[4,3-C]Pyridines, Their Use as Medicament, and Pharmaceutical Preparations Comprising Them SANOFI (FR) 2016-03-03 — — US disclosed
US-20160060259-A1 Substituted 4,5,6,7-Tetrahydro-1H-Pyrazolo[4,3-C]Pyridines, Their Use as Medicament, and Pharmaceutical Preparations Comprising Them SANOFI (FR) 2016-03-03 — — 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-20160060259-A1 Substituted 4,5,6,7-Tetrahydro-1H-Pyrazolo[4,3-C]Pyridines, Their Use as Medicament, and Pharmaceutical Preparations Comprising Them KCNA1, KCNT1, CACNA1I KCNK3 30/4885GRIN1 498/4885GRIN2B 2654/4885

“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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