SCHEMBL7919044

SCHEMBL7919044

O=C[Ti](OC(=O)c1cccc2ccccc12)(OC(=O)c1cccc2ccccc12)OC(=O)c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MMP3 P08254 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
CDC25B P30305 2/20 0.45
PTPN1 P18031 1/20 0.45
PLK1 P53350 1/20 0.45
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
HPGD P15428 2/20 0.43
ADRB2 P07550 2/20 0.43
ADRB1 P08588 2/20 0.43
ADRB3 P13945 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL7930266 0.82 NR4A1 (0.57) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL3681608 0.77 NR4A1 (0.55) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL137605 0.76 NR4A1 (0.63) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL29990575 0.76 NR4A1 (0.63) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL5987790 0.76 NR4A1 (0.63) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL29459734 0.76 NR4A1 (0.63) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL11422834 0.74 NR4A1 (0.61) KMT2ANR4A1NR4A2NR4A3POLB
Potassium SCHEMBL6929965 0.74 NR4A1 (0.61) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL669060 0.74 KMT2A (0.64) KMT2ANR4A1NR4A2NR4A3POLB
SCHEMBL28483908 0.74 NR4A1 (0.61) KMT2ANR4A1NR4A2NR4A3POLB

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