SCHEMBL3659339

SCHEMBL3659339

O=P(O)(O)C(O)Cn1ccnc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.71
GGPS1 O95749 3/20 0.49
BTN3A1 O00481 1/20 0.49
CA12 O43570 1/20 0.49
CA2 P00918 1/20 0.49
LMNA P02545 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP14 P50281 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CYP19A1 P11511 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP51A1 Q16850 1/20 0.42
HMOX1 P09601 1/20 0.42

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
Phosphonic Acid SCHEMBL10410285 0.93 FDPS (0.63) FDPSGGPS1BTN3A1CA12CA2
SCHEMBL515542 0.83 FDPS (1.00) FDPSGGPS1BTN3A1CA12CA2
SCHEMBL5451506 0.83 FDPS (0.58) FDPSGGPS1BTN3A1CA12CA2
Water SCHEMBL28274320 0.81 FDPS (0.96) FDPSGGPS1BTN3A1CA12CA2
Methyl Alcohol SCHEMBL9715289 0.80 FDPS (0.93) FDPSGGPS1BTN3A1CA12CA2
SCHEMBL5702824 0.76 FDPS (0.63) FDPSGGPS1BTN3A1CA12CA2
SCHEMBL8714524 0.76 FDPS (0.63) FDPSGGPS1BTN3A1CA12CA2
SCHEMBL6692428 0.76
SCHEMBL10247560 0.76 AGER (0.62) FDPSCYP19A1
SCHEMBL28381527 0.75 FDPS (0.76) FDPSGGPS1BTN3A1CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2921172-B1 Combination of an HMG-CoA reductase inhibitor and a farnesyl-pyrophosphatase synthase inhibitor for the treatment of diseases related to the persistence and/or accumulation of prenylated proteins UNIV AIX MARSEILLE (FR) 2018-09-12 EP disclosed
EP-2234620-B1 TRITHERAPY USED TO TREAT A PATIENT INFECTED BY HIV UNIV AIX MARSEILLE (FR) 2016-03-09 EP disclosed
EP-2921172-A1 Combination of an HMG-CoA reductase inhibitor and a farnesyl-pyrophosphatase synthase inhibitor for the treatment of diseases related to the persistence and/or accumulation of prenylated proteins Universite d'Aix Marseille (FR) 2015-09-23 EP disclosed
EP-2252282-B1 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION COMPRISING AN HMG-CoA REDUCTASE INHIBITOR AND A FARNESYL-PYROPHOSPHATE SYNTHASE INHIBITOR UNIV AIX MARSEILLE (FR) 2015-07-15 EP disclosed
EP-2034985-B1 COMBINATION OF AN HMG-COA REDUCTASE INHIBITOR AND A FARNESYL-PYROPHOSPHATASE SYNTHASE INHIBITOR FOR THE TREATMENT OF DISEASES RELATED TO THE PERSISTENCE AND/OR ACCUMULATION OF PRENYLATED PROTEINS UNIV AIX MARSEILLE (FR) 2015-05-06 EP disclosed
WO-2012071517-A3 NOVEL CRYSTALLINE FORMS THAR PHARMACEUTICALS, INC. (US) 2014-04-17 WO disclosed
EP-2225252-B1 C2-C5-ALKYL-IMIDAZOLE-BISPHOSPHONATES NOVARTIS AG (CH) 2012-06-27 EP disclosed
WO-2012071517-A2 NOVEL CRYSTALLINE FORMS THAR PHARMACEUTICALS, INC. (US) 2012-05-31 WO disclosed
EP-2252282-A2 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION Université de la Méditerranée - Aix-Marseille II (FR) 2010-11-24 EP disclosed
EP-2234620-A2 COMPOSITION AND METHODS USED DURING ANTI-HIV TREATMENT Université de la Méditerranée - Aix-Marseille II (FR) 2010-10-06 EP disclosed
EP-2225252-A1 C2-C5-ALKYL-IMIDAZOLE-BISPHOSPHONATES Novartis AG (CH) 2010-09-08 EP disclosed
WO-2009115652-A2 COMPOSITION AND METHODS USED DURING ANTI-HIV TREATMENT UNIVERSITE DE LA MEDITERANNEE, AIX-MARSEILLE II (FR) 2009-09-24 WO disclosed
WO-2009112653-A2 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION UNIVERSITE DE LA MEDITERRANEE, AIX-MARSEILLE II (FR) 2009-09-17 WO disclosed
WO-2009068567-A1 C2-C5-ALKYL-IMIDAZOLE-BISPHOSPHONATES NOVARTIS AG (CH) 2009-06-04 WO disclosed
US-20090137808-A1 PROCESS FOR MANUFACTURING BISPHOSPHONIC ACIDS ALBEMARLE CORPORATION (US) 2009-05-28 US disclosed
EP-2034985-A1 COMBINATION OF AN HMG-COA REDUCTASE INHIBITOR AND A FARNESYL-PYROPHOSPHATASE SYNTHASE INHIBITOR FOR THE TREATMENT OF DISEASES RELATED TO THE PERSISTENCE AND/OR ACCUMULATION OF PRENYLATED PROTEINS Université de la Méditerranée - Aix-Marseille II (FR) 2009-03-18 EP disclosed
WO-2008003864-A1 COMBINATION OF AN HMG-COA REDUCTASE INHIBITOR AND A FARNESYL-PYROPHOSPHATASE SYNTHASE INHIBITOR FOR THE TREATMENT OF DISEASES RELATED TO THE PERSISTENCE AND/OR ACCUMULATION OF PRENYLATED PROTEINS UNIVERSITE DE LA MEDITERRANEE AIX-MARSEILLE II (FR) 2008-01-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090137808-A1 PROCESS FOR MANUFACTURING BISPHOSPHONIC ACIDS BPGM, PGM2, GYPA FDPS 417/4885GGPS1 15/4885BTN3A1 3449/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.