SCHEMBL14199557

SCHEMBL14199557

CP(=O)(O)C(C[n+]1cccc(Br)c1)P(=O)(O)O

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 17/20 0.74
▸ FDPS P14324 2/20 0.44
▸ KMT2A Q03164 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.36

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
SCHEMBL12060613 0.91 GGPS1 (0.83) GGPS1FDPSKMT2AHDAC8
SCHEMBL14199570 0.82 GGPS1 (0.55) GGPS1FDPS
SCHEMBL14199582 0.82 GGPS1 (0.55) GGPS1FDPSHDAC8
SCHEMBL14199556 0.82 GGPS1 (0.55) GGPS1FDPSHDAC8
SCHEMBL12257842 0.81 GGPS1 (0.57) GGPS1FDPS
SCHEMBL14199553 0.81 GGPS1 (0.75) GGPS1FDPS
SCHEMBL14199572 0.79 GGPS1 (0.53) GGPS1FDPS
SCHEMBL14199560 0.79 GGPS1 (0.51) GGPS1FDPS
SCHEMBL14199559 0.78 GGPS1 (0.52) GGPS1FDPSKMT2A
SCHEMBL11952616 0.78 GGPS1 (0.53) 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
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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