SCHEMBL10888990

SCHEMBL10888990

CCSc1cc(C(C)(C)c2cc(SCC)c(O)c(SCC)c2)cc(SCC)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
ALOX12 P18054 2/20 0.43
CYP3A4 P08684 2/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CASP1 P29466 1/20 0.43
RECQL P46063 1/20 0.43
HIF1A Q16665 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KLF10 Q13118 1/20 0.37
GPR35 Q9HC97 1/20 0.37
CHEK1 O14757 1/20 0.37
DAPK3 O43293 1/20 0.37
RET P07949 1/20 0.37
PDGFRB P09619 1/20 0.37
PIM1 P11309 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
SCHEMBL10887211 0.88 KLF10 (0.49) ALOX15MAPK1HTTALOX12CYP3A4
SCHEMBL10886511 0.84 ALOX15 (0.43) ALOX15MAPK1HTTALOX12CYP3A4
SCHEMBL10884470 0.81 SHBG (0.44) ALOX15MAPK1HTTCYP3A4HSD17B10
SCHEMBL10884085 0.81 ALOX15 (0.41) ALOX15MAPK1HTTALOX12CYP3A4
SCHEMBL10889134 0.76 PTGS2 (0.33) PTGS1PTGS2SLC6A4GABRA1GABRB2
SCHEMBL10884108 0.76 ALOX15 (0.48) ALOX15MAPK1HTTALOX12CYP3A4
SCHEMBL10888337 0.75 KLF10 (0.46) ALOX15MAPK1HTTALOX12ALDH1A1
SCHEMBL10883977 0.74 SHBG (0.41) PTGS1PTGS2ESR1ESR2GABRA1
SCHEMBL10887180 0.72 KLF10 (0.44) ALOX15MAPK1HTTALOX12KLF10
SCHEMBL10889062 0.72 CYP2C19 (0.43) ALOX15CYP3A4HPGDTSHRHSD17B10

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
EP-0122203-B1 (HYDROCARBYLTHIO)PHENOLS AND THEIR PREPARATION ETHYL CORPORATION (US) 1986-12-30 EP disclosed
US-4533753-A SULFIDING A PHENOL USING A DISULFIDE AND ALUMINUM PHENOXIDE CATALYST; OXIDATION RESISTANCE; OIL ADDITIVES ETHYL CORPORATION (US) 1985-08-06 US disclosed
WO-1984004092-A1 (HYDROCARBYLTHIO)PHENOLS AND THEIR PREPARATION ETHYL CORP (US) 1984-10-25 WO disclosed
EP-0122203-A1 (Hydrocarbylthio)phenols and their preparation ETHYL CORPORATION (US) 1984-10-17 EP disclosed