SCHEMBL7793553

SCHEMBL7793553

CCOP(=O)(OCC)C(Nc1ncccc1OCc1ccccc1)P(=O)(OCC)OCC

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.50
PPIA P62937 16/20 0.49
GCK P35557 1/20 0.46
PPIF P30405 1/20 0.44
LTA4H P09960 1/20 0.44
MAPK14 Q16539 1/20 0.44

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
SCHEMBL7790466 0.83 PPIA (0.56) GRM5PPIALTA4HMAPK14
SCHEMBL8166679 0.78 FDPS (0.62)
SCHEMBL12794086 0.78 GRM5 (0.56) GRM5PPIAGCKPPIFLTA4H
SCHEMBL5155756 0.77 FDPS (0.47)
SCHEMBL8410675 0.76 FFAR1 (0.46) LTA4H
SCHEMBL7784728 0.74 NPC1 (0.49)
SCHEMBL7793618 0.74 P4HTM (0.47) GCKLTA4H
SCHEMBL14647654 0.73 GRM5 (0.60) GRM5PPIAGCKPPIFLTA4H
SCHEMBL5360999 0.72 FDPS (0.58) GRM5
SCHEMBL20628184 0.72 PPIA (0.55) GRM5PPIAGCKLTA4HMAPK14

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-0762883-B1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 2001-11-14 EP claimed
EP-0762883-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1997-03-19 EP claimed
WO-1995033466-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1995-12-14 WO claimed
EP-0762883-B1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 2001-11-14 EP disclosed
US-6083938-A TREATING BONE DISEASES SELECTED FROM THE GROUP CONSISTING OF OSTEOLYTIC BONE DISEASES DUE TO MALIGNANCY, PAGET'S DISEASE AND PRIMARY AND SECONDARY OSTEOPOROSIS LEIRAS OY (FI) 2000-07-04 US disclosed
US-5866556-A BONE DISORDERS LEIRAS OY (FI) 1999-02-02 US disclosed
EP-0762883-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1997-03-19 EP disclosed
WO-1995033466-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1995-12-14 WO disclosed