SCHEMBL30935156

SCHEMBL30935156

C=CC(=O)Nc1cccc(-c2cc(Br)n(C)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.53
▸ JAK3 P52333 8/20 0.53
▸ JAK1 P23458 5/20 0.51
▸ JAK2 O60674 4/20 0.51
▸ BTK Q06187 4/20 0.50
▸ ITK Q08881 2/20 0.48
▸ MAP2K7 O14733 2/20 0.47
▸ AURKA O14965 1/20 0.47
▸ CARM1 Q86X55 1/20 0.46
▸ PRMT6 Q96LA8 1/20 0.46
▸ PRMT1 Q99873 1/20 0.46
▸ PRMT8 Q9NR22 1/20 0.46
▸ SRC P12931 1/20 0.45
▸ EGFR P00533 2/20 0.45
▸ PLCG1 P19174 1/20 0.45
▸ TYK2 P29597 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
SCHEMBL30935219 0.75 PARP10 (0.52) JAK3JAK1JAK2BTKITK
SCHEMBL23721295 0.74 MAP2K7 (0.60) TGM2JAK3JAK1JAK2BTK
SCHEMBL26837665 0.72 MAPT (0.43) JAK3JAK1JAK2EGFR
SCHEMBL4103284 0.72 TGM2 (0.76) TGM2JAK3BTKITKMAP2K7
SCHEMBL30190722 0.71 JAK3 (0.51) TGM2JAK3JAK1JAK2BTK
SCHEMBL24150517 0.71 JAK3 (0.51) TGM2JAK3JAK1JAK2BTK
SCHEMBL24150191 0.71 JAK3 (0.51) JAK3JAK1JAK2BTKITK
SCHEMBL30190875 0.71 JAK3 (0.51) JAK3JAK1JAK2BTKITK
SCHEMBL25053131 0.71 JAK3 (0.56) JAK3JAK1JAK2BTKITK
SCHEMBL12807117 0.71 JAK3 (0.59) TGM2JAK3JAK1JAK2BTK

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
WO-2024125464-A1 TETRAHYDROISOQUINOLIN-ONE DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-20 — — WO disclosed
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