SCHEMBL18725253

SCHEMBL18725253

Nc1nccc2cc(CNC(=O)Oc3cn(Cc4ccc(N5CC[C@H](F)C5)nc4)nc3C(F)(F)F)ccc12

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.79
▸ KLK1 P06870 1/20 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
SCHEMBL18725283 1.00 KLKB1 (0.79) KLKB1KLK1
SCHEMBL18725242 0.93 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725271 0.93 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725267 0.93 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725270 0.93 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725275 0.91 KLKB1 (0.78) KLKB1
SCHEMBL18725260 0.87 KLKB1 (0.79) KLKB1KLK1
SCHEMBL18725238 0.87 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725255 0.87 KLKB1 (0.80) KLKB1KLK1
SCHEMBL18725254 0.86 KLKB1 (0.79) 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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