SCHEMBL22272927

SCHEMBL22272927

CN(C(=O)OC(C)(C)C)c1cc(Nc2ccc[nH]c2=O)nn2c(C(N)=O)cnc12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.43
▸ PDE4D Q08499 5/20 0.43
▸ AAK1 Q2M2I8 1/20 0.34
▸ STAT3 P40763 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
SCHEMBL22272928 0.83 TYK2 (0.39) TYK2PDE4D
SCHEMBL22272925 0.83 TYK2 (0.39) TYK2PDE4D
SCHEMBL22272916 0.80 TYK2 (0.56) TYK2PDE4D
SCHEMBL22272929 0.79 TYK2 (0.62) TYK2PDE4D
SCHEMBL22272906 0.78 TYK2 (0.55) TYK2
SCHEMBL22273237 0.78 TYK2 (0.50) TYK2
SCHEMBL22252393 0.67 MALT1 (0.36) AAK1
SCHEMBL22425951 0.65 MALT1 (0.35) —
SCHEMBL24263264 0.64 TYK2 (0.64) TYK2PDE4D
SCHEMBL22252388 0.63 LMNA (0.36) —

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-2020154474-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2020-07-30 — — WO disclosed
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