SCHEMBL30636208

SCHEMBL30636208

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2nnc(C)o2)c1OC

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.72
▸ JAK1 P23458 6/20 0.72
▸ CYP2C19 P33261 1/20 0.62
▸ JAK2 O60674 2/20 0.55

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
SCHEMBL16712862 1.00 TYK2 (0.72) TYK2JAK1CYP2C19JAK2
SCHEMBL21013819 0.91 TYK2 (0.60) TYK2JAK1CYP2C19JAK2
SCHEMBL26629703 0.85 TYK2 (0.78) TYK2JAK1JAK2
SCHEMBL30636403 0.85 TYK2 (0.78) TYK2JAK1JAK2
SCHEMBL26462376 0.85 TYK2 (0.73) TYK2JAK1CYP2C19JAK2
SCHEMBL25536722 0.84 TYK2 (0.88) TYK2JAK1CYP2C19JAK2
SCHEMBL15713486 0.84 TYK2 (0.71) TYK2JAK1
SCHEMBL25536688 0.84 TYK2 (0.88) TYK2JAK1CYP2C19JAK2
SCHEMBL30636240 0.84 TYK2 (0.70) TYK2JAK1CYP2C19JAK2
SCHEMBL15713476 0.84 TYK2 (1.00) TYK2JAK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023213308-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF 苏州隆博泰药业有限公司 2023-11-09 — — WO claimed
WO-2023213308-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF 苏州隆博泰药业有限公司 2023-11-09 — — WO disclosed
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