SCHEMBL17777274

SCHEMBL17777274

CCCCCCCCOc1ccc[n+](CC(P(=O)(O)O)P(=O)(O)O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 20/20 1.00
▸ FDPS P14324 2/20 0.87

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
SCHEMBL29604112 1.00 GGPS1 (1.00) GGPS1FDPS
SCHEMBL29525919 0.93 GGPS1 (1.00) GGPS1FDPS
SCHEMBL12257803 0.85 GGPS1 (0.74) GGPS1FDPS
SCHEMBL12060535 0.83 GGPS1 (0.72) GGPS1FDPS
SCHEMBL12257805 0.82 GGPS1 (0.88) GGPS1FDPS
SCHEMBL12257820 0.80 GGPS1 (0.88) GGPS1FDPS
SCHEMBL12060529 0.80 GGPS1 (0.86) GGPS1FDPS
SCHEMBL12060539 0.80 GGPS1 (0.86) GGPS1FDPS
SCHEMBL12257807 0.80 GGPS1 (0.86) GGPS1FDPS
SCHEMBL12257838 0.80 GGPS1 (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016081281-A1 LIPOPHILIC BISPHOSPHONATES AND METHODS OF USE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2016-05-26 — — WO disclosed
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