SCHEMBL6238370

SCHEMBL6238370

COc1cc2c(cc1OC)C([Zr](Oc1ccc(F)cc1)Oc1ccc(F)cc1)C=C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.38
NFE2L2 Q16236 2/20 0.35
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
TRPA1 O75762 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
BRD4 O60885 2/20 0.33
CCL2 P13500 1/20 0.33
THRB P10828 1/20 0.33
POLB P06746 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
TP53 P04637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL6685865 0.77 HTR1A (0.36) CYP1A2CYP2D6CYP2C19
SCHEMBL9016938 0.72 BRD4 (0.40) CYP3A4BRD4CCL2TSHR
SCHEMBL5085032 0.70 KDM4C (0.34) KDM4CNFE2L2MEN1KMT2ATRPA1
SCHEMBL9016934 0.63 BRD4 (0.42) CYP3A4BRD4CCL2ALDH1A1TSHR
SCHEMBL28131615 0.63 BRD4 (0.42) CYP3A4BRD4CCL2TSHR
SCHEMBL28130908 0.63 BRD4 (0.42) CYP3A4BRD4CCL2TSHR
SCHEMBL7032000 0.63 BRD4 (0.42) CYP3A4BRD4CCL2ALDH1A1TSHR
Hydrochloric Acid SCHEMBL9016936 0.62 BRD4 (0.41) CYP3A4BRD4CCL2TSHR
SCHEMBL8041045 0.61 BRD4 (0.41) CYP3A4BRD4CCL2ALDH1A1TSHR
Hydrochloric Acid SCHEMBL7823998 0.61 BRD4 (0.41) CYP3A4BRD4CCL2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1541598-A1 Olefin polymerization catalyst and olefin polymerization method using the same MARUZEN PETROCHEMICAL CO., LTD. (JP) 2005-06-15 EP disclosed