SCHEMBL7919540

SCHEMBL7919540

CC1=C(C)C(C)([Ti](OC(=O)c2cccc3ccccc23)(OC(=O)c2cccc3ccccc23)OC(=O)c2cccc3ccccc23)C2=C1CCCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
CDC25B P30305 2/20 0.37
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TLR2 O60603 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 1/20 0.34
PLK1 P53350 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7928129 0.81 KMT2A (0.39) KMT2APOLBGAACDC25BALDH1A1
SCHEMBL7924650 0.80 KMT2A (0.38) KMT2APOLBGAACDC25BALDH1A1
SCHEMBL7925838 0.74 KCNN4 (0.38) SLC6A2SLC6A3
SCHEMBL7924737 0.72
SCHEMBL7927803 0.71
SCHEMBL7925623 0.70
SCHEMBL7930871 0.70
SCHEMBL7924648 0.70 POLB (0.38) KMT2APOLBGAACDC25BALDH1A1
SCHEMBL7925818 0.69 CDC25B (0.43) KMT2APOLBGAACDC25BALDH1A1
SCHEMBL7919337 0.69 POLB (0.42) KMT2APOLBGAACDC25BALDH1A1

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