SCHEMBL7514976

SCHEMBL7514976

c1cnn([Pb](n2cccn2)(n2cccn2)n2cccn2)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.33
FBP1 P09467 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
G6PD P11413 1/20 0.31
KMT2A Q03164 1/20 0.31
NOTUM Q6P988 1/20 0.30

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
SCHEMBL3054290 0.65
SCHEMBL7821507 0.62 FBP1 (0.37) NOS1FBP1KDM4EALDH1A1MEN1
SCHEMBL9464929 0.62 NOS1 (0.38) NOS1FBP1KDM4EALDH1A1MEN1
SCHEMBL3196512 0.61
SCHEMBL3203791 0.59
SCHEMBL6719067 0.59
SCHEMBL367143 0.58
SCHEMBL1375630 0.58 NOS1 (0.35) NOS1FBP1KDM4EALDH1A1MEN1
SCHEMBL1002769 0.58
SCHEMBL74432 0.58

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165568-A4 METAL COMPOUNDS CONTAINING NEUTRAL, MULTIDENTATE AZACYCLIC LIGANDS, CATALYSTS USING THEM, OLEFIN POLYMERIZATION METHODS USING THEM EQUISTAR CHEM LP (US) 2002-10-16 EP disclosed
US-6384229-B1 SILICON, TIN, GERMANIUM, OR LEAD; PYRAZOLYL, TRIAZOLYL, OR TETRAAZOLYL RING LIGAND; CATALYSTS FOR OLEFIN POLYMERIZATION EQUISTAR CHEMICALS, L.P. 2002-05-07 US disclosed
EP-1165568-A1 METAL COMPOUNDS CONTAINING NEUTRAL, MULTIDENTATE AZACYCLIC LIGANDS, CATALYSTS USING THEM, OLEFIN POLYMERIZATION METHODS USING THEM Equistar Chemicals L.P. (US) 2002-01-02 EP disclosed
US-6180552-B1 OLEFIN POLYMERIZATION COORDINATION CATALYSTS EQUISTAR CHEMICALS, L.P. 2001-01-30 US disclosed
WO-2000059914-A1 METAL COMPOUNDS CONTAINING NEUTRAL, MULTIDENTATE AZACYCLIC LIGANDS, CATALYSTS USING THEM, OLEFIN POLYMERIZATION METHODS USING THEM EQUISTAR CHEMICALS, L.P. (US) 2000-10-12 WO disclosed