SCHEMBL7790467

SCHEMBL7790467

CCOP(=O)(OCC)C(Nc1cccnc1Cl)P(=O)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.40
RAB9A P51151 6/20 0.40
NPC1 O15118 5/20 0.40
ALOX12 P18054 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL7790669 0.76 FDPS (0.54) POLBRAB9ANPC1KMT2AALDH1A1
SCHEMBL8166679 0.76 FDPS (0.62) POLBRAB9ANPC1ALOX12KMT2A
SCHEMBL5360999 0.75 FDPS (0.58) POLBKMT2AMEN1ALDH1A1GAA
SCHEMBL5155756 0.75 FDPS (0.47) POLBRAB9ANPC1HTT
SCHEMBL7784728 0.72 NPC1 (0.49) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL5366533 0.71 FDPS (0.59) POLBRAB9ANPC1ALDH1A1LMNA
SCHEMBL8166911 0.71 FDPS (0.40) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL7793613 0.70 L3MBTL1 (0.45) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL7794298 0.70 FDPS (0.60) RAB9ANPC1ALDH1A1LMNAHTT
SCHEMBL2037028 0.70 POLB (0.47) POLBRAB9ANPC1ALOX12KMT2A

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 4 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
US-5866556-A BONE DISORDERS LEIRAS OY (FI) 1999-02-02 US disclosed