SCHEMBL8994323

SCHEMBL8994323

CCc1csc(C(P(=O)(O)O)P(O)(O)=S)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL2945021 0.79 DAO (0.35) DAO
SCHEMBL5940644 0.78 CA12 (0.35) DAO
SCHEMBL8589356 0.76 PTPRC (0.33) ALDH1A1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8588595 0.71 SRC (0.41) RAB9A
SCHEMBL8362825 0.68 ALDH1A1 (0.38) ALDH1A1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8589342 0.67 CYP2C19 (0.33) SMN1; SMN2
SCHEMBL12763852 0.66
SCHEMBL19277439 0.65 PTGS2 (0.34)
SCHEMBL11076533 0.64 HPGD (0.31)
SCHEMBL15675290 0.64 PTGS2 (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
US-5527940-A SUPPRESSES INTERLEUKIN-1 AND BONE DESTRUCTION DURING OSTEOPOROSIS; ANTIINFLAMMATORY AGENTS TORAY INDUSTRIES, INC. (JP) 1996-06-18 US disclosed