SCHEMBL18544508

SCHEMBL18544508

Cc1cnn(Cc2ccc(Cn3cc(OC(=O)NCc4ccc(CN)cc4)nn3)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 20/20 0.70
KLK1 P06870 5/20 0.56

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
SCHEMBL18544525 0.90 KLKB1 (0.73) KLKB1KLK1
SCHEMBL18544489 0.89 KLKB1 (0.73) KLKB1KLK1
SCHEMBL18544527 0.85 KLKB1 (0.68) KLKB1KLK1
SCHEMBL18544531 0.84 KLKB1 (0.71) KLKB1KLK1
SCHEMBL15873751 0.82 KLKB1 (1.00) KLKB1KLK1
SCHEMBL18544487 0.80 KLKB1 (0.72) KLKB1KLK1
SCHEMBL15873823 0.78 KLKB1 (1.00) KLKB1KLK1
SCHEMBL18544507 0.76 KLKB1 (0.74) KLKB1KLK1
SCHEMBL18544491 0.75 KLKB1 (0.71) KLKB1KLK1
SCHEMBL18544500 0.75 KLKB1 (0.73) 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-2943483-B1 BENZYLAMINE DERIVATIVES KALVISTA PHARMACEUTICALS LTD (GB) 2017-03-01 EP claimed