SCHEMBL8938038

SCHEMBL8938038

O=P(O)(O)C(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.90

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACP3 P15309 10/20 0.90
▸ CA12 O43570 1/20 0.55
▸ CA1 P00915 1/20 0.55
▸ MMP2 P08253 1/20 0.55
▸ PNMT P11086 1/20 0.51
▸ CES2 O00748 2/20 0.51
▸ PGK1 P00558 3/20 0.47
▸ PGK2 P07205 3/20 0.47
▸ IDO1 P14902 1/20 0.45
▸ TDO2 P48775 1/20 0.45
▸ PTPN5 P54829 1/20 0.44

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
SCHEMBL8824569 0.84 ACP3 (0.67) ACP3CA12CA1MMP2PNMT
SCHEMBL9401137 0.84 PGK1 (0.70) ACP3CA12CA1MMP2PNMT
SCHEMBL9401118 0.83 ACP3 (0.65) ACP3CA12CA1MMP2PNMT
SCHEMBL8956963 0.79 ACP3 (0.68) ACP3CA12CA1MMP2PNMT
SCHEMBL8938034 0.77 ACP3 (0.87) ACP3CA12CA1MMP2PNMT
SCHEMBL778799 0.76 ACP3 (0.56) ACP3CA12MMP2CES2PGK1
SCHEMBL4135956 0.75 PNMT (0.65) ACP3PNMTCES2IDO1TDO2
Phosphoric Acid SCHEMBL28200180 0.75 PGK1 (0.61) ACP3CA12CA1MMP2CES2
SCHEMBL4086256 0.74 PNMT (0.58) ACP3PNMTCES2IDO1TDO2
SCHEMBL5848264 0.73 PNMT (0.53) ACP3CA12CA1MMP2PNMT

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
US-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 — — US claimed
US-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 — — US disclosed
Send feedback