SCHEMBL9494838

SCHEMBL9494838

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ HPN P05981 1/20 0.47
▸ SIRT5 Q9NXA8 1/20 0.47
▸ CA2 P00918 3/20 0.40
▸ CA1 P00915 2/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ POLB P06746 1/20 0.39
▸ TYR P14679 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ BLM P54132 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ATM Q13315 2/20 0.37
▸ HIF1A Q16665 2/20 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
SCHEMBL9550783 0.91 MAPT (0.45) MAPTALOX15HPNSIRT5CA2
SCHEMBL9550796 0.84 MAPT (0.44) MAPTALOX15HPNSIRT5CA2
SCHEMBL9550802 0.81 HSD17B10 (0.32) ALOX15CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL646924 0.81 ALOX15 (0.63) MAPTALOX15HPNSIRT5CA2
SCHEMBL9168126 0.81 ALOX15 (0.50) MAPTALOX15HPNSIRT5CA2
SCHEMBL7095066 0.80 HPN (0.42) MAPTALOX15HPNSIRT5CA2
SCHEMBL9492905 0.78 ALOX15 (0.47) MAPTALOX15HPNSIRT5CA2
SCHEMBL8702044 0.78 ALOX15 (0.59) MAPTALOX15HPNSIRT5CA2
SCHEMBL8492285 0.76 ALOX15 (0.57) MAPTALOX15HPNSIRT5CA2
SCHEMBL8834137 0.76 MAPT (0.57) MAPTALOX15HPNSIRT5CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5189038-A Administering phenolic thioethers G. D. SEARLE AND CO. (US) 1993-02-23 — — US claimed
WO-1992004026-A1 USE OF 4-HYDROXYPHENYL-THIOETHERS FOR STIMULATING SUPEROXIDE GENERATION G.D. SEARLE & CO. (US) 1992-03-19 — — WO claimed
US-5229421-A Antiallergens, antiinflammatory agents G. D. SEARLE & CO. (US) 1993-07-20 — — US disclosed
US-5208262-A Administering 4-hydroxythiophenol derivatives G. D. SEARLE & CO. (US) 1993-05-04 — — US disclosed
US-5189038-A Administering phenolic thioethers G. D. SEARLE AND CO. (US) 1993-02-23 — — US disclosed
WO-1992004026-A1 USE OF 4-HYDROXYPHENYL-THIOETHERS FOR STIMULATING SUPEROXIDE GENERATION G.D. SEARLE & CO. (US) 1992-03-19 — — WO disclosed
US-5082854-A Enzyme inhibitors G. D. SEARLE & CO. (US) 1992-01-21 — — US disclosed
US-5047593-A Antiinflammatory And Antiallergy Agents G. D. SEARLE & CO. (US) 1991-09-10 — — US disclosed
EP-0218782-B1 LIPOXYGENASE-INHIBITING COMPOSITION AND HYDROXYPHENYLTHIOALKYLCARBONYL COMPOUNDS G.D. Searle & Co. (US) 1990-05-16 — — EP disclosed
US-4857558-A ANTIINFLAMMATORY AGENTS AND-OR ANTIALLERGENS G. D. SEARLE & CO. (US) 1989-08-15 — — US disclosed
Send feedback