SCHEMBL8634829

SCHEMBL8634829

CCC(C(=O)O)P(=O)(O)O.O=C(O)CCCP(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.53
LPAR3 Q9UBY5 3/20 0.39
LPAR2 Q9HBW0 1/20 0.39
TYMS P04818 1/20 0.38
NAALAD2 Q9Y3Q0 1/20 0.38
AKR1B1 P15121 1/20 0.38

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
SCHEMBL1960686 0.82 FOLH1 (0.54) FOLH1
Alcohol SCHEMBL1487742 0.81 LPAR3 (0.48) LPAR3LPAR2TYMSAKR1B1
Butane SCHEMBL7718806 0.81 LPAR3 (0.54) LPAR3LPAR2AKR1B1
Methyl Alcohol SCHEMBL28871419 0.80 FOLH1 (0.52) FOLH1
SCHEMBL307497 0.80 TYMS (0.58) FOLH1LPAR3LPAR2TYMS
Butane SCHEMBL7718918 0.78 FOLH1 (0.50) FOLH1
SCHEMBL11196604 0.78 TYMS (0.55) FOLH1LPAR3LPAR2TYMS
Butane SCHEMBL7717026 0.75 LPAR3 (0.58) LPAR3LPAR2AKR1B1
SCHEMBL9461890 0.75 FOLH1 (0.76) FOLH1NAALAD2
SCHEMBL454023 0.74 LMNA (0.58) FOLH1LPAR3LPAR2TYMSAKR1B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0551154-B1 Self-extinguishing polymeric compositions MINI RICERCA SCIENT TECNOLOG (IT) 1998-07-15 EP disclosed
EP-0551154-A1 Self-extinguishing polymeric compositions MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1993-07-14 EP disclosed