SCHEMBL28047229

SCHEMBL28047229

CCn1c(C(=O)O)cc(C)c1Cc1ccc(Cn2cc(C)cn2)cc1.CNCc1ccc(N)cc1C

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLK1 P06870 9/20 0.68
▸ KLKB1 P03952 18/20 0.62

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
SCHEMBL28047225 0.90 KLKB1 (0.68) KLK1KLKB1
SCHEMBL16247145 0.87 KLKB1 (0.69) KLK1KLKB1
SCHEMBL28047171 0.84 KLKB1 (0.62) KLK1KLKB1
SCHEMBL15874021 0.81 KLK1 (1.00) KLK1KLKB1
SCHEMBL28825219 0.80 KLKB1 (0.65) KLK1KLKB1
SCHEMBL28047221 0.80 KLKB1 (0.64) KLK1KLKB1
SCHEMBL28047298 0.80 KLKB1 (0.68) KLK1KLKB1
SCHEMBL28047228 0.80 KLKB1 (0.59) KLK1KLKB1
SCHEMBL28047219 0.79 KLKB1 (0.71) KLK1KLKB1
SCHEMBL28047231 0.79 KLKB1 (0.58) KLK1KLKB1

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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