SCHEMBL9507433

SCHEMBL9507433

CCSc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
ALOX15 P16050 2/20 0.61
HPN P05981 1/20 0.61
SIRT5 Q9NXA8 1/20 0.61
PTGS1 P23219 4/20 0.53
PTGS2 P35354 3/20 0.53
CA2 P00918 4/20 0.52
CA1 P00915 2/20 0.52
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 1/20 0.50
TYR P14679 1/20 0.50
LMNA P02545 3/20 0.46
TSHR P16473 3/20 0.46
GAA P10253 1/20 0.46
RECQL P46063 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44

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
SCHEMBL5692187 0.85 ALOX15 (0.63) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL646924 0.85 ALOX15 (0.63) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL9154935 0.84 ALOX15 (0.57) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL10817343 0.83 MAPT (0.61) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL8309159 0.82 ALOX15 (0.59) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL8702044 0.82 ALOX15 (0.59) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL8699143 0.81 HPN (0.53) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL8834137 0.80 MAPT (0.57) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL9328124 0.80 ALOX15 (0.57) MAPTALOX15HPNSIRT5PTGS1
SCHEMBL8493361 0.80 ALOX15 (0.57) MAPTALOX15HPNSIRT5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0293895-B1 PHENOLIC THIOETHERS AS INHIBITORS OF 5-LIPOXYGENASE G.D. Searle & Co. (US) 1993-08-11 EP claimed
US-4847305-A Phenolic thioethers as inhibitors of 5-lipoxygenase G. D. SEARLE & CO. (US) 1989-07-11 US claimed
EP-0293895-A1 Phenolic thioethers as inhibitors of 5-lipoxygenase G.D. Searle & Co. (US) 1988-12-07 EP claimed
EP-2952505-A1 A hindered phenol compound, preparation thereof and use thereof as an antioxidant China Petroleum & Chemical Corporation (CN) 2015-12-09 EP disclosed
EP-0293895-B1 PHENOLIC THIOETHERS AS INHIBITORS OF 5-LIPOXYGENASE G.D. Searle & Co. (US) 1993-08-11 EP disclosed
US-4847305-A Phenolic thioethers as inhibitors of 5-lipoxygenase G. D. SEARLE & CO. (US) 1989-07-11 US disclosed
EP-0293895-A1 Phenolic thioethers as inhibitors of 5-lipoxygenase G.D. Searle & Co. (US) 1988-12-07 EP disclosed