SCHEMBL10805890

SCHEMBL10805890

CC(c1ccccc1)n1nc(-c2ccc(F)cc2)c2c1CCN(C)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 7/20 0.64

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
SCHEMBL10799585 0.80 KCNK3 (0.53) KCNK3
SCHEMBL10803230 0.79 PTGS2 (0.52) —
SCHEMBL14784264 0.78 KCNK3 (1.00) KCNK3
SCHEMBL14791416 0.78 KCNK3 (1.00) KCNK3
SCHEMBL14784781 0.78 KCNK3 (1.00) KCNK3
SCHEMBL14784424 0.78 KCNK3 (1.00) KCNK3
SCHEMBL10800970 0.76 KCNK3 (0.67) KCNK3
SCHEMBL10806622 0.75 — —
SCHEMBL10801762 0.74 — —
SCHEMBL16216972 0.74 KCNK3 (0.90) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0086422-B1 PHARMACOLOGICALLY ACTIVE PYRAZOLO(4,3-C)PYRIDINES GRUPPO LEPETIT S.p.A. (IT) 1987-09-30 — — EP disclosed
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