SCHEMBL8408546

SCHEMBL8408546

CC(C)Oc1ccc(OCCCOc2c(C(C)C)cc(O)cc2C(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
KMT2A Q03164 2/20 0.39
ADRB2 P07550 1/20 0.38
LTA4H P09960 2/20 0.38
NR5A1 Q13285 1/20 0.38
PPARD Q03181 1/20 0.38
CARM1 Q86X55 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
NSD2 O96028 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
MEN1 O00255 1/20 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
SCHEMBL8408371 0.97 NR5A1 (0.41) ALDH1A1KDM4EKMT2AADRB2LTA4H
SCHEMBL8407394 0.85 KDM4E (0.41) ALDH1A1KDM4EADRB2LTA4HNR5A1
SCHEMBL8405394 0.85 DRD4 (0.40) ALDH1A1KMT2AADRB2LTA4HNR5A1
SCHEMBL8408530 0.82 PLAU (0.44) ALDH1A1KDM4EKMT2AADRB2LTA4H
SCHEMBL8407740 0.82 KDM4E (0.44) ALDH1A1KDM4EADRB2LTA4HNR5A1
SCHEMBL8405465 0.82 NR5A1 (0.41) ALDH1A1KMT2AADRB2LTA4HNR5A1
SCHEMBL8407960 0.82 ALDH1A1 (0.43) ALDH1A1PPARDL3MBTL1CYP2C9GPR84
SCHEMBL8409144 0.81 GPR84 (0.41) ALDH1A1KDM4EKMT2ALTA4HNR5A1
SCHEMBL8657247 0.79 PLAU (0.44) ALDH1A1KDM4EKMT2AADRB2LTA4H
SCHEMBL8405684 0.79 HTT (0.40) ALDH1A1KDM4EKMT2ACARM1SMN1; SMN2

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 4 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
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP disclosed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO disclosed