SCHEMBL10799585

SCHEMBL10799585

CC(c1ccccc1)n1nc(-c2ccc(F)cc2)c2c1CCNC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 3/20 0.53

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
SCHEMBL14784245 0.94 KCNK3 (0.58) KCNK3
SCHEMBL10805890 0.80 KCNK3 (0.64) KCNK3
SCHEMBL10799578 0.77 PTGS2 (0.53) —
SCHEMBL10806301 0.76 — —
SCHEMBL10801116 0.74 HTR7 (0.80) KCNK3
SCHEMBL10804671 0.73 — —
SCHEMBL10806664 0.73 — —
SCHEMBL10800194 0.73 HTR7 (0.64) —
SCHEMBL19110595 0.72 SIGMAR1 (0.47) KCNK3
SCHEMBL10799831 0.71 — —

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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