SCHEMBL12048188

SCHEMBL12048188

CP(=O)(O)C(O)(C[n+]1cccc(-c2ccc(F)cc2)c1)P(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 7/20 0.62
▸ FDPS P14324 5/20 0.40
▸ PTPN5 P54829 3/20 0.36
▸ LMNA P02545 2/20 0.33
▸ MMP1 P03956 1/20 0.32
▸ MMP2 P08253 1/20 0.32
▸ MMP3 P08254 1/20 0.32
▸ MMP7 P09237 1/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ MMP8 P22894 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ MMP14 P50281 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL12060371 0.92 GGPS1 (0.67) GGPS1FDPSPTPN5LMNAMMP1
SCHEMBL12048146 0.90 GGPS1 (0.76) GGPS1FDPSPTPN5LMNAKDM4E
SCHEMBL14199552 0.89 GGPS1 (0.63) GGPS1FDPSPTPN5LMNAMMP3
SCHEMBL12048161 0.88 GGPS1 (0.59) GGPS1FDPSPTPN5
SCHEMBL12048195 0.85 GGPS1 (0.51) GGPS1FDPS
SCHEMBL12048208 0.85 GGPS1 (0.59) GGPS1FDPSLMNAKDM4EALDH1A1
SCHEMBL12048205 0.85 GGPS1 (0.59) GGPS1FDPSLMNAMMP2MMP9
SCHEMBL12048151 0.85 GGPS1 (0.78) GGPS1FDPSPTPN5LMNA
SCHEMBL12048173 0.82 GGPS1 (0.56) GGPS1FDPS
SCHEMBL12048201 0.82 GGPS1 (0.55) GGPS1FDPS

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-8071573-B2 Bisphosphonate compounds and methods for bone resorption diseases, cancer, bone pain, immune disorders, and infectious diseases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS, A BODY CORPORATE AND POLITIC OF THE STATE OF ILLINOIS (US) 2011-12-06 — — US disclosed
US-7358361-B2 Biophosphonate compounds and methods for bone resorption diseases, cancer, bone pain, immune disorders, and infectious diseases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-04-15 — — US disclosed
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