SCHEMBL30739106

SCHEMBL30739106

N#Cc1ccc(Cc2ccc(Cn3cc(C(=O)NCc4ccc(C(=N)N)cc4)cn3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 16/20 0.73
▸ KLK1 P06870 4/20 0.53
▸ EPHX2 P34913 1/20 0.46
▸ KDM1A O60341 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ EGLN2 Q96KS0 1/20 0.45
▸ ITK Q08881 1/20 0.44

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
SCHEMBL30739158 0.91 KLKB1 (0.71) KLKB1KLK1ITK
SCHEMBL30739171 0.88 KLKB1 (0.69) KLKB1KLK1
SCHEMBL30739146 0.87 KLKB1 (0.77) KLKB1KLK1
SCHEMBL30739270 0.86 KLKB1 (0.67) KLKB1KLK1
SCHEMBL30739103 0.85 KLKB1 (0.74) KLKB1KLK1
SCHEMBL1981938 0.84 KLKB1 (1.00) KLKB1KLK1
SCHEMBL30739101 0.84 KLKB1 (0.83) KLKB1KLK1
SCHEMBL22878729 0.84 KLKB1 (0.69) KLKB1KLK1ITK
SCHEMBL30739095 0.83 KLKB1 (0.82) KLKB1KLK1
Hydrochloric Acid SCHEMBL1985633 0.83 KLKB1 (0.98) 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
EP-4561993-A1 INHIBITORS OF PLASMA KALLIKREIN Rezolute, Inc. (US) 2025-06-04 — — EP disclosed
WO-2024025907-A1 INHIBITORS OF PLASMA KALLIKREIN REZOLUTE, INC. (US) 2024-02-01 — — WO disclosed
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