SCHEMBL3426413

SCHEMBL3426413

O=Cc1cc[c]c(-c2nnn[nH]2)c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.30

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
SCHEMBL9872227 0.76
SCHEMBL5917 0.73 CYP2A6 (0.35) KCNJ1
SCHEMBL9872905 0.72
SCHEMBL9872511 0.72 SNCA (0.30)
SCHEMBL5318854 0.71 TRIM24 (0.41)
SCHEMBL196009 0.69
SCHEMBL3397443 0.66 ALDH1A1 (0.37) KCNJ1
SCHEMBL31006315 0.66 ALDH1A1 (0.37) KCNJ1
SCHEMBL1545888 0.66
SCHEMBL7211249 0.65 NOTUM (0.41)

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-2246348-A1 Coupling reactions useful in the preparation of (1h-tetrazol-5-yl)-biphenyl derivatives Novartis AG (CH) 2010-11-03 EP disclosed