SCHEMBL31184402

SCHEMBL31184402

CC1OCC2(CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1NS(=O)(=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.38
▸ USP2 O75604 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ EPHX2 P34913 1/20 0.36
▸ NAMPT P43490 7/20 0.35
▸ RECQL P46063 1/20 0.35
▸ EPHX1 P07099 1/20 0.35

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
SCHEMBL28448337 1.00 GPR119 (0.38) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL28356333 1.00 GPR119 (0.38) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL29564055 1.00 GPR119 (0.38) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL28360243 1.00 GPR119 (0.38) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL28452438 0.82 GPR119 (0.40) GPR119USP2SMN1; SMN2EPHX2RECQL
SCHEMBL30626319 0.82 USP2 (0.40) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL30626326 0.82 USP2 (0.40) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL31184417 0.82 GPR119 (0.40) GPR119USP2SMN1; SMN2EPHX2RECQL
SCHEMBL23657144 0.81 USP2 (0.40) GPR119USP2SMN1; SMN2EPHX2NAMPT
SCHEMBL22814636 0.81 USP2 (0.39) GPR119USP2SMN1; SMN2EPHX2NAMPT

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-112625028-B Compounds and compositions for inhibiting SHP2 activity 诺华股份有限公司 2024-10-29 — — CN disclosed
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