SCHEMBL9560920

SCHEMBL9560920

CCOc1ccc(C(COCc2ccc(F)c(Cc3ccccc3)c2)C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 2/20 0.40
SLC5A1 P13866 1/20 0.40
FFAR1 O14842 8/20 0.37
CNR2 P34972 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
DHFR P00374 1/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PLA2G1B P04054 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL9560866 0.91 FFAR1 (0.41) SLC5A2SLC5A1FFAR1DHFRPPARD
SCHEMBL9570712 0.91 SLC5A1 (0.40) SLC5A2SLC5A1FFAR1KMT2ASMN1; SMN2
SCHEMBL9570839 0.87 TACR1 (0.39) MEN1KMT2ASMN1; SMN2LMNAMAPT
SCHEMBL9560815 0.86 MRGPRX4 (0.41) SLC5A2SLC5A1FFAR1CNR2MEN1
SCHEMBL9804313 0.83 SLC5A2 (0.40) SLC5A2SLC5A1FFAR1CNR2MEN1
SCHEMBL409992 0.83 LTA4H (0.41) FFAR1CNR2MEN1KMT2AL3MBTL1
SCHEMBL9570584 0.82 KDM4E (0.37) FFAR1CNR2MEN1KMT2AL3MBTL1
SCHEMBL9570722 0.82 FFAR1 (0.36) FFAR1CNR2MEN1KMT2AL3MBTL1
SCHEMBL409247 0.81 FFAR1 (0.51) FFAR1CNR2TP53PKMNFKB1
SCHEMBL9561406 0.81 FFAR1 (0.51) FFAR1CNR2TP53PKMNFKB1

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 6 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-5196610-A INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-23 US disclosed
EP-0211561-B1 INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-11 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
EP-0211561-A1 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-02-25 EP disclosed