SCHEMBL9790637

SCHEMBL9790637

Cc1conc1NC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 15/20 0.51
FDFT1 P37268 2/20 0.45
CA12 O43570 2/20 0.43
CA1 P00915 1/20 0.43
MMP8 P22894 1/20 0.43
CA9 Q16790 1/20 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
SCHEMBL9790653 0.70 TRPM8 (0.56) FDPSFDFT1CA12CA1MMP8
SCHEMBL9790731 0.69 FDPS (0.51) FDPSFDFT1CA12CA1MMP8
SCHEMBL22766547 0.68
SCHEMBL8974849 0.68 FDPS (0.50) FDPSFDFT1CA12CA1MMP8
SCHEMBL8167477 0.68 FDPS (1.00) FDPSFDFT1CA12CA1MMP8
SCHEMBL9790767 0.67 FDPS (0.53) FDPSFDFT1CA12CA1MMP8
SCHEMBL11401437 0.66 FDPS (0.47) FDPSFDFT1
SCHEMBL9790674 0.64 FDPS (0.44) FDPSFDFT1CA12CA1MMP8
SCHEMBL9819252 0.63 FDPS (0.47) FDPSFDFT1CA12CA1MMP8
SCHEMBL11060452 0.63 CA12 (0.53) FDPSFDFT1CA12CA1MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274346-B1 SUBSTITUTED AMINOMETHANE-DIPHOSPHONIC ACIDS CIBA-GEIGY AG (CH) 1991-03-06 EP claimed
EP-0274346-A1 Substituted aminomethane-diphosphonic acids CIBA-GEIGY AG (CH) 1988-07-13 EP claimed
EP-0282320-B1 BISPHOSPHONIC ACID DERIVATIVES AND MEDICINES CONTAINING THE SAME YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-12-11 EP disclosed
US-5057505-A Treatment of illnesses attributed to calcium metabolism disorders CIBA-GEIGY CORPORATION (US) 1991-10-15 US disclosed
EP-0274346-B1 SUBSTITUTED AMINOMETHANE-DIPHOSPHONIC ACIDS CIBA-GEIGY AG (CH) 1991-03-06 EP disclosed
US-4973576-A ANTIARTHRITIC AGENTS, TREATMENT OF HYPERCALCEMIA YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-11-27 US disclosed
EP-0282320-A1 Bisphosphonic acid derivatives and medicines containing the same YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-09-14 EP disclosed
EP-0274346-A1 Substituted aminomethane-diphosphonic acids CIBA-GEIGY AG (CH) 1988-07-13 EP disclosed