SCHEMBL10426422

SCHEMBL10426422

CCCP(=O)(CCC)CCCP(=O)(CCC)CCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 7/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP3A4 P08684 1/20 0.39
GABBR2 O75899 2/20 0.39
GABBR1 Q9UBS5 2/20 0.39
GABRR1 P24046 1/20 0.39
LPAR3 Q9UBY5 3/20 0.38
LPAR2 Q9HBW0 1/20 0.38
TYMS P04818 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
SCHEMBL10424958 0.91 TRPM8 (0.39) TRPM8L3MBTL1HPGDSMN1; SMN2CYP3A4
SCHEMBL1726162 0.90 HPGD (0.52) TRPM8L3MBTL1HPGDSMN1; SMN2CYP3A4
SCHEMBL1725975 0.90 HPGD (0.52) TRPM8L3MBTL1HPGDSMN1; SMN2CYP3A4
SCHEMBL11889581 0.90 HPGD (0.52) TRPM8L3MBTL1HPGDSMN1; SMN2CYP3A4
SCHEMBL563253 0.89 L3MBTL1 (0.48) TRPM8L3MBTL1HPGDSMN1; SMN2GABBR2
SCHEMBL409091 0.85 LPAR3 (0.56) TRPM8LPAR3LPAR2
SCHEMBL3017433 0.83 ALDH1A1 (0.43) TRPM8L3MBTL1HPGDSMN1; SMN2GABBR2
SCHEMBL9617461 0.83 GABBR2 (0.60) CYP3A4GABBR2GABBR1GABRR1
SCHEMBL11521300 0.83 LPAR3 (0.54) TRPM8HPGDSMN1; SMN2GABBR2GABBR1
SCHEMBL152127 0.83 HPGD (0.56) TRPM8HPGDSMN1; SMN2CYP3A4GABBR2

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-4902833-A Bisphosphine dioxides UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) 1990-02-20 US disclosed