SCHEMBL8408992

SCHEMBL8408992

O=C(OCCCOc1c(Cl)cc(O)cc1Cl)c1ccc(OC(F)(F)C(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ESR1 P03372 3/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 1/20 0.41
NR1H2 P55055 1/20 0.41
RNASEL Q05823 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 2/20 0.38
TRPV1 Q8NER1 1/20 0.37
CHRM1 P11229 1/20 0.37
SLC6A2 P23975 1/20 0.37
KDR P35968 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL8405681 0.86 FFAR4 (0.37) TSHRMAPK1ALDH1A1HSD17B10TRPV1
SCHEMBL8407711 0.83 FFAR4 (0.37) TSHRALDH1A1HSD17B10CYP3A4KCNH2
SCHEMBL8409166 0.82 ESR1 (0.43) TSHRESR1MAPK1SMN1; SMN2LMNA
SCHEMBL8658023 0.78 TDP1 (0.58) TSHRESR1MAPK1SMN1; SMN2LMNA
SCHEMBL8405870 0.78 CETP (0.39)
SCHEMBL8405614 0.77 FFAR4 (0.47) CYP3A4KCNH2CACNA1CSCN5AFFAR4
SCHEMBL7073022 0.76 L3MBTL1 (0.51) TSHRESR1MAPK1SMN1; SMN2LMNA
SCHEMBL8657702 0.76 TDP1 (0.63) TSHRESR1MAPK1SMN1; SMN2LMNA
SCHEMBL8408597 0.75 CETP (0.39)
SCHEMBL8408253 0.75 HRH3 (0.51) TSHRESR1MAPK1SMN1; SMN2LMNA

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