SCHEMBL8949630

SCHEMBL8949630

CCCCC(c1ccccc1)P(=O)(OC)OC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACP3 P15309 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL27991962 0.90 POLB (0.45) GAAPOLBALDH1A1SMN1; SMN2ACP3
SCHEMBL11459792 0.84 ESR1 (0.38) GAAALDH1A1SMN1; SMN2TDP1
SCHEMBL27991952 0.82 POLB (0.47) GAAPOLBALDH1A1SMN1; SMN2ACP3
SCHEMBL9659039 0.80 NPSR1 (0.44) POLBTDP1MEN1KMT2ANPSR1
SCHEMBL1246417 0.79 ACP3 (0.62) POLBACP3
SCHEMBL7540487 0.77 TAAR1 (0.44) GAAPOLBALDH1A1SMN1; SMN2ACP3
SCHEMBL6661383 0.77 GAA (0.41) GAAPOLBALDH1A1SMN1; SMN2TDP1
Ammonia Solution, Strong SCHEMBL11437728 0.75 POLB (0.49) POLBACP3NPSR1
SCHEMBL3696125 0.75 ALDH1A1 (0.41) GAAPOLBALDH1A1SMN1; SMN2ACP3
SCHEMBL11297491 0.73 ACP3 (0.58) ACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5574024-A Methylene phosphonoalkylphosphinates, pharmaceutical compositions, and methods for treating abnormal calcium and phosphate metabolism EBETINO FRANK H (US) 1996-11-12 US disclosed
EP-0298553-B1 METHYLENE PHOSPHONOALKYLPHOSPHINATES, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM Norwich Eaton Pharmaceuticals, Inc. (US) 1992-01-15 EP disclosed
EP-0298553-A1 Methylene phosphonoalkylphosphinates, pharmaceutical compositions, and methods for treating abnormal calcium and phosphate metabolism Norwich Eaton Pharmaceuticals, Inc. (US) 1989-01-11 EP disclosed