SCHEMBL3383290

SCHEMBL3383290

C[Mg]C1C=C(c2ccccc2)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
PTPN1 P18031 2/20 0.32
PTPRC P08575 1/20 0.32
PTPRF P10586 1/20 0.32
CDC25B P30305 1/20 0.32
BACE1 P56817 1/20 0.32
GPR3 P46089 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL3383007 0.77 ALDH1A1 (0.31) ALDH1A1MAPK1
SCHEMBL3383646 0.75 GPR3 (0.34) ALDH1A1GPR3
SCHEMBL28849090 0.72 ALDH1A1 (0.38) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL28806317 0.71 ALDH1A1 (0.37) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL28303653 0.71 BACE1 (0.38) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL7542406 0.70 ALDH1A1 (0.33) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL28351851 0.70 ALDH1A1 (0.33) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL6762451 0.69 ALDH1A1 (0.36) ALDH1A1MAPK1PTPN1PTPRCPTPRF
Hydrochloric Acid SCHEMBL911083 0.69 ALDH1A1 (0.35) ALDH1A1MAPK1PTPN1PTPRCPTPRF
SCHEMBL29281412 0.69 ALDH1A1 (0.35) ALDH1A1MAPK1PTPN1PTPRCPTPRF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709586-B2 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. (KR) 2010-05-04 US disclosed
US-20070142221-A1 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. 2007-06-21 US disclosed