SCHEMBL7793579

SCHEMBL7793579

CCOP(=O)(OCC)C(Nc1ccc(OC)cn1)P(=O)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
GAA P10253 2/20 0.43
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
FDPS P14324 3/20 0.40
FDFT1 P37268 1/20 0.38
DEGS1 O15121 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KMT2A Q03164 1/20 0.37
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 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
SCHEMBL8519948 0.84 KDM4E (0.40) KDM4ENPC1RAB9AALDH1A1LMNA
SCHEMBL7793618 0.82 P4HTM (0.47) KDM4EGAARAB9AKMT2AEPHX2
SCHEMBL7794298 0.82 FDPS (0.60) KDM4ETDP1FDPSFDFT1NPC1
SCHEMBL9223520 0.82 KDM4E (0.44) KDM4ECA12CA1CA2CA9
SCHEMBL7793195 0.82 KDM4E (0.44) KDM4EFDPSFDFT1DEGS1
SCHEMBL7793628 0.80 FDPS (0.60) CA12CA1CA2CA9FDPS
SCHEMBL7790648 0.78 KMT2A (0.49) KDM4EGAACA1CA2NPC1
SCHEMBL8407752 0.76 L3MBTL1 (0.40) GAACA12CA1CA2CA9
SCHEMBL9226173 0.76 KDM4E (0.39) KDM4ETDP1FDPSFDFT1KMT2A
SCHEMBL9220494 0.76 KDM4E (0.39) KDM4ETDP1FDPSFDFT1NPC1

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