SCHEMBL9340201

SCHEMBL9340201

CCCC(O)P(=O)(O)CCC#N

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.38
TSHR P16473 1/20 0.37
METAP1 P53582 2/20 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
SCHEMBL9336312 0.76 ACHE (0.33) TSHR
SCHEMBL6360421 0.72 CYP1A2 (0.53) TSHR
SCHEMBL9340203 0.71 FDPS (0.35) FDPSMETAP1
Butane SCHEMBL7714667 0.71 LPAR3 (0.44) FDPSTSHR
Hydrochloric Acid SCHEMBL9336338 0.70 CYP1A2 (0.51) TSHR
SCHEMBL9417045 0.70 GABBR2 (0.39) FDPSTSHR
SCHEMBL9417123 0.69 MEN1 (0.42) TSHR
SCHEMBL10585820 0.69 FDPS (0.42) FDPSMETAP1
Butane SCHEMBL7718897 0.68 LPAR3 (0.52) FDPSTSHR
SCHEMBL440079 0.68 FDPS (0.40) FDPSTSHRMETAP1

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
EP-0319482-B1 Novel substituted propane phosphinic acid compounds CIBA GEIGY AG (CH) 1994-05-18 EP claimed