SCHEMBL8410067

SCHEMBL8410067

Cc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 4/20 0.37
POLB P06746 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33
MCL1 Q07820 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.32
KCNH2 Q12809 1/20 0.32
CACNA1C Q13936 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
SCHEMBL8408745 0.96 TP53 (0.39) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8405401 0.92 HTT (0.38) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8405610 0.90 KDM4E (0.38) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL2345060 0.90 HTT (0.36) TP53MAPK1HTTMAPTSMN1; SMN2
SCHEMBL8405459 0.89 KDM4E (0.40) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8407866 0.88 KDM4E (0.36) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8409083 0.88 KDM4E (0.39) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL7977888 0.88 KDM4E (0.36) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8407738 0.87 TP53 (0.40) TP53MAPK1KDM4EPOLBCYP1A2
SCHEMBL8407281 0.87 KDM4E (0.38) TP53MAPK1KDM4EPOLBCYP1A2

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-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US disclosed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed