SCHEMBL31591080

SCHEMBL31591080

N#CCc1ccccc1Cn1cc(C(N)=O)cn1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ CREBBP Q92793 1/20 0.40
▸ KLKB1 P03952 7/20 0.39
▸ HPGD P15428 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.34
▸ JAK2 O60674 3/20 0.34
▸ JAK1 P23458 3/20 0.34
▸ TEC P42680 1/20 0.34
▸ TXK P42681 1/20 0.34
▸ BMX P51813 1/20 0.34
▸ BTK Q06187 1/20 0.34
▸ JAK3 P52333 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALKBH1 Q13686 1/20 0.33

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
SCHEMBL30739039 0.82 GRM2 (0.40) ALDH1A1L3MBTL1MAPTCREBBPKLKB1
SCHEMBL31591060 0.81 KDM4E (0.49) ALDH1A1L3MBTL1MAPTKLKB1HPGD
SCHEMBL20481563 0.80 ALDH1A1 (0.51) ALDH1A1L3MBTL1MAPTPKMKLKB1
SCHEMBL30739265 0.79 KLKB1 (0.71) KLKB1HPGDLMNA
SCHEMBL30482323 0.76 MAOB (0.49) ALDH1A1L3MBTL1MAPTPKMKLKB1
SCHEMBL28616063 0.76 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPTPKMKLKB1
SCHEMBL15964732 0.76 KLKB1 (0.60) ALDH1A1L3MBTL1CREBBPKLKB1LMNA
SCHEMBL17443354 0.75 TGM2 (0.47) ALDH1A1L3MBTL1MAPTPKMLMNA
SCHEMBL31591101 0.75 L3MBTL1 (0.39) ALDH1A1L3MBTL1KLKB1LMNAKDM4E
SCHEMBL31591066 0.74 KDM4E (0.44) ALDH1A1L3MBTL1MAPTKLKB1LMNA

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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