SCHEMBL28500620

SCHEMBL28500620

C[C@H]1CN(C(=O)O)[C@@H](COS(C)(=O)=O)CN1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.34
GAA P10253 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
SCHEMBL29246082 1.00 SMN1; SMN2 (0.39) SMN1; SMN2TSHRMAPTGAA
SCHEMBL29246084 1.00 SMN1; SMN2 (0.39) SMN1; SMN2TSHRMAPTGAA
SCHEMBL29153245 0.83 ATM (0.30)
SCHEMBL29153244 0.83 ATM (0.30)
SCHEMBL3301225 0.78 TSHR (0.33) SMN1; SMN2TSHR
SCHEMBL2543637 0.76 DPP4 (0.34)
SCHEMBL16468582 0.76 DPP4 (0.34)
SCHEMBL18546458 0.76 DPP4 (0.34)
SCHEMBL20745908 0.76 CA1 (0.32)
SCHEMBL19948739 0.76 CA1 (0.32)

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-111989321-A KRAS G12C inhibitors 米拉蒂治疗股份有限公司 2020-11-24 CN disclosed