SCHEMBL31591063

SCHEMBL31591063

CNC(=O)Cc1ccc(Cn2cc(C(N)=O)cn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 12/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 1/20 0.46
▸ KLK1 P06870 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HDAC4 P56524 1/20 0.41

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
SCHEMBL30739046 0.83 GRM2 (0.47) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL17696410 0.82 KLKB1 (0.55) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL31591069 0.82 KLKB1 (0.45) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL30739084 0.81 KLKB1 (0.76) KLKB1KLK1
SCHEMBL31591076 0.80 KLKB1 (0.51) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL15964732 0.79 KLKB1 (0.60) KLKB1KDM4EALDH1A1LMNAHSD17B10
SCHEMBL17693909 0.78 ALDH1A1 (0.49) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL31591087 0.78 KLKB1 (0.46) KLKB1KDM4EALDH1A1LMNAKLK1
SCHEMBL2272882 0.78 L3MBTL1 (0.57) KLKB1KDM4EALDH1A1HSD17B10MEN1
SCHEMBL31591091 0.76 KLKB1 (0.48) KLKB1KDM4EALDH1A1LMNAKLK1

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
CN-120051460-A Plasma kallikrein inhibitors 瑞泽路特有限公司 2025-05-27 — — CN disclosed
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