SCHEMBL24590580

SCHEMBL24590580

CN(C)/C=N\c1nccc2c1[nH]c(=O)n2[C@@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ DDB1 Q16531 1/20 0.33
▸ CRBN Q96SW2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ USP30 Q70CQ3 2/20 0.32
▸ JAK3 P52333 1/20 0.31
▸ SPR P35270 2/20 0.31
▸ CCNT1 O60563 1/20 0.31
▸ CDK9 P50750 1/20 0.31
▸ GPR119 Q8TDV5 3/20 0.31
▸ CCR5 P51681 1/20 0.31
▸ HCAR1 Q9BXC0 1/20 0.31
▸ FPR2 P25090 1/20 0.30

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
SCHEMBL29737066 1.00 JAK1 (0.33) JAK1KDM4EDDB1CRBNALDH1A1
SCHEMBL30111817 0.87 HCAR1 (0.41) JAK1USP30GPR119HCAR1FPR2
SCHEMBL18289981 0.87 HCAR1 (0.41) JAK1USP30GPR119HCAR1FPR2
SCHEMBL18818280 0.87 HCAR1 (0.41) JAK1USP30GPR119HCAR1FPR2
SCHEMBL18285718 0.87 HCAR1 (0.41) JAK1USP30GPR119HCAR1FPR2
SCHEMBL18818279 0.87 HCAR1 (0.41) JAK1USP30GPR119HCAR1FPR2
SCHEMBL29737131 0.83 KDM4E (0.37) JAK1KDM4ESPRCCNT1CDK9
SCHEMBL24590579 0.83 KDM4E (0.37) JAK1KDM4ESPRCCNT1CDK9
SCHEMBL22902683 0.82 JAK1 (0.38) JAK1ALDH1A1JAK3
SCHEMBL22902497 0.81 ALDH1A1 (0.34) ALDH1A1SPR

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-2022140511-A1 4-AMINO-3-(4-PHENOXYPHENYL)-1,3- DIHYDRO-2H-IMIDAZO[4,5-C]PYRIDIN-2-ONE DERIVATIVES AND SALTS THEREOF GENZYME CORPORATION (US) 2022-06-30 — — WO disclosed
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