SCHEMBL7919043

SCHEMBL7919043

C[O-].O=C(O[Ti+](OC(=O)c1cccc2ccccc12)OC(=O)c1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.52
NR4A2 P43354 1/20 0.52
NR4A3 Q92570 1/20 0.52
KMT2A Q03164 4/20 0.51
POLB P06746 3/20 0.51
GAA P10253 1/20 0.51
PLK1 P53350 1/20 0.50
CDC25B P30305 2/20 0.49
MMP3 P08254 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
PTPN1 P18031 1/20 0.46
HPGD P15428 5/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 4/20 0.46
ADRB2 P07550 2/20 0.45
ADRB1 P08588 2/20 0.45
ADRB3 P13945 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL7928127 0.79 NR4A1 (0.52) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29580762 0.78 MAPT (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL522791 0.78 MAPT (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL137605 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29990575 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL5987790 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL29459734 0.77 NR4A1 (0.63) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL28775345 0.77 MAPT (0.61) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL28866217 0.77 MAPT (0.61) NR4A1NR4A2NR4A3KMT2APOLB
SCHEMBL11055936 0.77 MAPT (0.61) NR4A1NR4A2NR4A3KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed