SCHEMBL9570700

SCHEMBL9570700

Fc1ccc(COCC(c2ccc(Cl)cc2)C(F)(F)F)cc1Oc1ccc(Br)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
CCR5 P51681 4/20 0.32
SLC6A4 P31645 6/20 0.32
HTR2A P28223 4/20 0.32
KCNH2 Q12809 4/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
EPAS1 Q99814 1/20 0.31
SCN9A Q15858 2/20 0.31
KMT2A Q03164 1/20 0.31
FFAR1 O14842 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL9570621 1.00 PPARG (0.33) PPARGPPARACCR5SLC6A4HTR2A
SCHEMBL9570877 0.92 DPP4 (0.33) SLC6A4ESR1ESR2MAOB
SCHEMBL9570834 0.91 TACR1 (0.34) ESR1ESR2FFAR1
SCHEMBL9561512 0.90 TACR1 (0.36) PPARGPPARAFFAR1
SCHEMBL9570788 0.89 RXRA (0.32) PPARGPPARAESR1ESR2
SCHEMBL9862440 0.89 SLC6A4 (0.36) PPARGSLC6A4HTR2AKCNH2ESR1
SCHEMBL9862431 0.89 SLC6A4 (0.36) PPARGSLC6A4HTR2AKCNH2ESR1
SCHEMBL9570690 0.89 SLC6A4 (0.41) PPARGPPARASLC6A4HTR2AKCNH2
SCHEMBL9561457 0.89 CACNA1C (0.36) PPARGPPARASLC6A4KMT2AFFAR1
SCHEMBL9560849 0.87 MAPT (0.40) SLC6A4HTR2AKCNH2KMT2AFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545891-A2 Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-09 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed