SCHEMBL8405682

SCHEMBL8405682

Oc1cc(Cl)c(OCc2ccc(Cl)c(Oc3ccccc3)c2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.43
TP53 P04637 2/20 0.40
THRB P10828 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAOB P27338 1/20 0.40
NPC1 O15118 1/20 0.40
MITF O75030 1/20 0.40
XBP1 P17861 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
CYP1A2 P05177 1/20 0.39

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
SCHEMBL8405493 0.88 MAOB (0.44) TTRTP53THRBGAAMAPT
SCHEMBL8405445 0.85 FFAR1 (0.49) THRBMAOBRXRARXRBCYP1A2
SCHEMBL8661414 0.83 MEN1 (0.34) TTRTP53THRBGAAMAPT
SCHEMBL8405485 0.83 FFAR1 (0.51) MRGPRX4
SCHEMBL8405763 0.78 LMNA (0.50) TP53THRBGAAMAPTMEN1
SCHEMBL8408376 0.78 CYP4F2 (0.56) THRBGAAMAPTMEN1KMT2A
SCHEMBL8405791 0.78 RAB9A (0.48) MAPTNPC1RAB9ACYP1A2MRGPRX4
SCHEMBL8408574 0.78 LMNA (0.61) TP53GAAMAPTMEN1KMT2A
SCHEMBL11160284 0.77 TTR (0.65) TTRTP53GAAMAPTHPGD
SCHEMBL8406038 0.77 IDO1 (0.53) MAPTMEN1KMT2AMAOBNPC1

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