SCHEMBL18725252

SCHEMBL18725252

Nc1nn(Cc2ccc(N3CCCC3)nc2)cc1OC(=O)NCc1ccc2c(N)nccc2c1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.76
▸ KLK1 P06870 2/20 0.58

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
SCHEMBL18725275 0.91 KLKB1 (0.78) KLKB1
SCHEMBL18725251 0.91 KLKB1 (0.78) KLKB1KLK1
SCHEMBL18725225 0.84 KLKB1 (0.77) KLKB1
SCHEMBL18725246 0.82 KLKB1 (0.77) KLKB1
SCHEMBL18725250 0.82 KLKB1 (0.77) KLKB1
SCHEMBL18725219 0.82 KLKB1 (0.78) KLKB1
SCHEMBL18725283 0.82 KLKB1 (0.79) KLKB1KLK1
SCHEMBL18725253 0.82 KLKB1 (0.79) KLKB1KLK1
SCHEMBL18725260 0.81 KLKB1 (0.79) KLKB1KLK1
SCHEMBL18725229 0.81 KLKB1 (0.75) KLKB1KLK1

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-2999697-B1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LTD (GB) 2017-04-19 — — EP claimed
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