SCHEMBL11765728

SCHEMBL11765728

CCCCC(CCCC)(c1c(C)cc(C)c(C(CCCC)(CCCC)P(=O)(O)O)c1C)P(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 12/20 0.42
▸ GGPS1 O95749 7/20 0.38
▸ PGK1 P00558 3/20 0.37
▸ PGK2 P07205 3/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ SMPD1 P17405 2/20 0.36
▸ LPAR1 Q92633 1/20 0.36
▸ LPAR3 Q9UBY5 1/20 0.36

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
SCHEMBL11762352 0.94 GGPS1 (0.47) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11761885 0.90 FDPS (0.39) FDPSGGPS1PGK1PGK2ESR1
SCHEMBL11755718 0.88 FDPS (0.48) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11763080 0.87 FDPS (0.42) FDPSGGPS1PGK1PGK2ESR1
SCHEMBL11762042 0.84 FDPS (0.48) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11759309 0.82 PGK1 (0.41) PGK1PGK2ESR1ESR2
SCHEMBL11761970 0.82 FDPS (0.54) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11765029 0.81 GGPS1 (0.55) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11727825 0.79 PGK1 (0.36) PGK1PGK2
SCHEMBL11724415 0.79 NPSR1 (0.37) PGK1PGK2ESR1ESR2

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-4061681-A Method for the preparation of mono- or poly [dialkyl or dicycloalkylphosphonylmethyl] aromatic carbocyclic compounds AMERICAN CYANAMID COMPANY (US) 1977-12-06 — — US disclosed
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