SCHEMBL7925408

SCHEMBL7925408

O=C(O[Ti](OC(=O)c1cccc2ccccc12)(OC(=O)c1cccc2ccccc12)C1C2=C(CCCC2)C2=C1CCCC2)c1cccc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
POLB P06746 2/20 0.44
GAA P10253 1/20 0.44
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
TLR2 O60603 1/20 0.37
MMP3 P08254 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
CDC25B P30305 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 2/20 0.36
SMN1; SMN2 Q16637 2/20 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
SCHEMBL7919337 0.88 POLB (0.42) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924823 0.88 POLB (0.42) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7925418 0.80 GAA (0.36) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7925415 0.79 GAA (0.38) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7928125 0.76 POLB (0.39) KMT2APOLBGAANR4A1NR4A2
Hydrochloric Acid SCHEMBL7927393 0.76 POLB (0.43) KMT2APOLBGAANR4A1NR4A2
Hydrochloric Acid SCHEMBL7925463 0.76 KMT2A (0.43) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924589 0.76 KMT2A (0.44) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924648 0.76 POLB (0.38) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7919336 0.75 GAA (0.36) 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