SCHEMBL31591069

SCHEMBL31591069

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

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 11/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ LMNA P02545 3/20 0.43
▸ KLK1 P06870 2/20 0.42
▸ HDAC4 P56524 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ NUDT1 P36639 1/20 0.39
▸ GRM2 Q14416 1/20 0.39

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
SCHEMBL30739126 0.88 HSD17B10 (0.55) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL30739230 0.84 GRM2 (0.48) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL17696410 0.82 KLKB1 (0.55) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL31591063 0.82 KLKB1 (0.47) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL31591076 0.80 KLKB1 (0.51) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL15964732 0.79 KLKB1 (0.60) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL31591087 0.78 KLKB1 (0.46) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL2272882 0.78 L3MBTL1 (0.57) KLKB1KDM4EALDH1A1HSD17B10
SCHEMBL17693909 0.78 ALDH1A1 (0.49) KLKB1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL5728441 0.76 PLA2G10 (0.48) KDM4EALDH1A1KLK1HDAC4HDAC6

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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