SCHEMBL28047221

SCHEMBL28047221

CNCc1ccc(N)cc1C.Cc1cnn(Cc2ccc(Cn3cc(C(=O)O)nn3)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 19/20 0.64
▸ KLK1 P06870 3/20 0.48

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
SCHEMBL28047165 0.89 KLKB1 (0.64) KLKB1KLK1
SCHEMBL28047171 0.88 KLKB1 (0.62) KLKB1KLK1
SCHEMBL28047224 0.86 KLKB1 (0.65) KLKB1KLK1
SCHEMBL28825219 0.82 KLKB1 (0.65) KLKB1KLK1
SCHEMBL15873913 0.82 KLKB1 (0.65) KLKB1
SCHEMBL28047229 0.80 KLK1 (0.68) KLKB1KLK1
SCHEMBL15873787 0.78 KLKB1 (1.00) KLKB1KLK1
SCHEMBL28047220 0.76 KLKB1 (0.63) KLKB1KLK1
SCHEMBL28825216 0.74 KLKB1 (0.65) KLKB1KLK1
SCHEMBL28825241 0.73 KLKB1 (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105143201-A Benzylamine derivatives KALVISTA PHARMACEUTICALS LTD 2015-12-09 — — CN claimed
CN-105143201-A Benzylamine derivatives KALVISTA PHARMACEUTICALS LTD 2015-12-09 — — CN disclosed
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