SCHEMBL9560338

SCHEMBL9560338

CCCc1ccc(C(O)(COCc2ccc(F)c(Oc3ccccc3)c2)C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
PPARG P37231 1/20 0.33
PSEN1 P49768 1/20 0.33
NR3C2 P08235 1/20 0.33
FFAR1 O14842 1/20 0.33
LTA4H P09960 1/20 0.33
EPHX2 P34913 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
NR1H2 P55055 1/20 0.33
LPAR1 Q92633 1/20 0.32
LPAR5 Q9H1C0 1/20 0.32
TACR1 P25103 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL9560793 0.90 NR4A1 (0.36) NR3C2RAB9ALPAR1LPAR5TACR1
SCHEMBL9560403 0.89 NR3C2 (0.37) ALOX5NR3C2LPAR1LPAR5
SCHEMBL9560585 0.89 MAPK14 (0.39) ALOX5PPARGPSEN1FFAR1LTA4H
SCHEMBL9560512 0.89 LMNA (0.40) ALOX5PPARGPSEN1FFAR1LTA4H
SCHEMBL9560878 0.89 LMNA (0.41) NR3C2FFAR1GAARAB9ALPAR1
SCHEMBL9560709 0.89 L3MBTL1 (0.36) PPARGFFAR1GAA
SCHEMBL9560800 0.88 SMN1; SMN2 (0.35) NR3C2LPAR1LPAR5TACR1POLB
SCHEMBL9561340 0.87 LTA4H (0.38) LTA4HEPHX2TACR1
SCHEMBL9561491 0.86 ALOX5 (0.33) ALOX5PPARGPSEN1FFAR1LTA4H
SCHEMBL9561496 0.86 ALOX5 (0.33) ALOX5PPARGPSEN1FFAR1LTA4H

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-5225607-A Multistage etherification or dehydrohalogenation and reductive dechlorination IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-07-06 US 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
EP-0211561-A1 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-02-25 EP disclosed