SCHEMBL11759783

SCHEMBL11759783

CCCCC(CCCC)(c1ccc2cc(C(CCCC)(CCCC)P(=O)(O)O)ccc2c1)P(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 5/20 0.46
▸ FDPS P14324 9/20 0.42
▸ ESR1 P03372 3/20 0.41
▸ ESR2 Q92731 3/20 0.41
▸ CETP P11597 1/20 0.38
▸ GGPS1 O95749 6/20 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
SCHEMBL11764166 0.94 GGPS1 (0.47) PTPN1FDPSCETPGGPS1
SCHEMBL11760531 0.90 PTPN1 (0.49) PTPN1FDPSESR1ESR2
SCHEMBL11757262 0.83 PTPN1 (0.42) PTPN1FDPSESR1ESR2
SCHEMBL11762641 0.82 PTPN1 (0.52) PTPN1ESR1ESR2
SCHEMBL5441305 0.81 HDAC1 (0.46) FDPSESR1ESR2GGPS1
SCHEMBL11760251 0.81 LMNA (0.38) PTPN1ESR1ESR2
SCHEMBL2032074 0.80 FDPS (0.46) FDPSESR1ESR2GGPS1
SCHEMBL11406548 0.79 PTPN1 (0.46) PTPN1FDPSCETPGGPS1
SCHEMBL11763191 0.77 FDPS (0.48) FDPSESR1ESR2GGPS1
SCHEMBL6769521 0.77 FDPS (0.42) FDPSESR1ESR2GGPS1

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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