SCHEMBL8092196

SCHEMBL8092196

O=P([O-])([O-])c1ccccc1P(=O)([O-])[O-].OP(O)O.[Zr+4]

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA5A P35218 1/20 0.33
NPC1 O15118 2/20 0.31
POLB P06746 2/20 0.31
PTK2B Q14289 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
FDPS P14324 1/20 0.30
SRC P12931 2/20 0.30
CFTR P13569 1/20 0.30

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
SCHEMBL9407116 0.89 CA4 (0.33) CA2CA4CA5ANPC1POLB
SCHEMBL8842457 0.75 MYC (0.34) POLBALDH1A1
SCHEMBL8842465 0.75 MYC (0.34) POLBALDH1A1
SCHEMBL8146494 0.73 CYP3A4 (0.44) CA2CA4CA5ANPC1POLB
Phenylphosphonic Acid SCHEMBL4618743 0.73 CA2 (0.48) CA2CA4CA5ACA12CA9
SCHEMBL4251055 0.72 MYC (0.38) CA2POLBCA9ALDH1A1
Phenylphosphonic Acid SCHEMBL8842281 0.71 CA2 (0.46) CA2CA4CA5AALDH1A1CFTR
Phosphoric Acid SCHEMBL6012157 0.69 MYC (0.36) CA2CA4CA5APOLB
Phosphoric Acid SCHEMBL6012155 0.69 MYC (0.36) CA2CA4CA5APOLB
SCHEMBL8092199 0.69 PTK2B (0.39) CA2CA4CA5ANPC1POLB

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
EP-0736539-B1 Mesoporous crystalline acid composition of a diphosphonate-phosphite of a tetravalent metal which can be used as a catalyst ENITECNOLOGIE SPA (IT) 2000-12-20 EP disclosed
US-5892080-A Mesoporous crystalline acid composition of a diphosphonate-phosphite of a tetravalent metal which can be used as a catalyst ENIRICERCHE S.P.A. (IT) 1999-04-06 US disclosed
EP-0736539-A2 Mesoporous crystalline acid composition of a diphosphonate-phosphite of a tetravalent metal which can be used as a catalyst ENIRICERCHE S.p.A. (IT) 1996-10-09 EP disclosed