SCHEMBL7925550

SCHEMBL7925550

O=C(O[Ti](OC(=O)c1cccc2ccccc12)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21)c1cccc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
NR4A1 P22736 1/20 0.44
NR4A2 P43354 1/20 0.44
NR4A3 Q92570 1/20 0.44
MEN1 O00255 4/20 0.43
HPGD P15428 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KCNH2 Q12809 1/20 0.43
MMP3 P08254 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CDC25B P30305 2/20 0.40

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
SCHEMBL7924589 0.89 KMT2A (0.44) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7930266 0.76 NR4A1 (0.57) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7925046 0.76 KMT2A (0.41) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924480 0.75 F2 (0.44) KMT2APOLBGAAMEN1ALDH1A1
SCHEMBL5742509 0.74 CDC25B (0.49) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7930323 0.73 POLB (0.56) KMT2APOLBGAAMEN1HPGD
SCHEMBL7919044 0.71 KMT2A (0.50) KMT2APOLBGAANR4A1NR4A2
SCHEMBL5987790 0.70 NR4A1 (0.63) KMT2APOLBGAANR4A1NR4A2
SCHEMBL137605 0.70 NR4A1 (0.63) KMT2APOLBGAANR4A1NR4A2
SCHEMBL29990575 0.70 NR4A1 (0.63) KMT2APOLBGAANR4A1NR4A2

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