SCHEMBL3826147

SCHEMBL3826147

CC(C)(C)c1cc(SSc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
ALOX15 P16050 4/20 0.45
MAPT P10636 3/20 0.45
HPN P05981 1/20 0.45
SIRT5 Q9NXA8 1/20 0.45
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
TYR P14679 2/20 0.45
POLB P06746 1/20 0.45
HSP90AA1 P07900 1/20 0.45
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 2/20 0.42
TSHR P16473 2/20 0.42
CYP3A4 P08684 1/20 0.42
NR5A2 O00482 1/20 0.40
NR5A1 Q13285 1/20 0.40

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
SCHEMBL1685533 0.92 CA2 (0.43) CA2CA1ALOX15MAPTHPN
SCHEMBL31131308 0.88 CA2 (0.46) CA2CA1ALOX15MAPTHPN
SCHEMBL3820150 0.88 CA2 (0.46) CA2CA1ALOX15MAPTHPN
Toluene SCHEMBL27758377 0.87 CYP2C9 (0.48) CA2CA1ALOX15MAPTHPN
SCHEMBL14773884 0.82 CYP2C19 (0.43) CA2CA1ALOX15MAPTHPN
SCHEMBL27897712 0.82 CA2 (0.42) CA2CA1ALOX15MAPTHPN
SCHEMBL35141 0.82 CA2 (0.67) CA2CA1ALOX15MAPTHPN
SCHEMBL3820781 0.79 SMN1; SMN2 (0.68) CA2CA1ALOX15MAPTHPN
SCHEMBL8986512 0.78 CA2 (0.61) CA2CA1ALOX15MAPTHPN
SCHEMBL14671408 0.78 GABRA1 (0.41) CA2CA1ALOX15MAPTHPN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269569-B1 ESTERIFICATION PROCESS WITH CALCIUM HYDROXYBENZYL PHOSPHONATE-PHENOL SULFIDE CATALYST SYSTEM CIBA-GEIGY AG (CH) 1992-05-13 EP claimed
WO-2023018522-A1 METHODS FOR PREPARING POLYHYDROXYALKANOATE POLYMER COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2023-02-16 WO disclosed
EP-1406726-B1 ORGANOALUMINIUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEM PLASTIC (US) 2009-08-26 EP disclosed
US-7456127-B2 Organoaluminum catalyst UNION CARBIDE CHEMICALS AND PLASTICS TECHNOLOGY CORPORATION 2008-11-25 US disclosed
EP-1871860-A1 LUBRICATING OIL COMPOSITION WITH REDUCED PHOSPHORUS LEVELS ALBEMARLE CORPORATION (US) 2008-01-02 EP disclosed
WO-2006105267-A1 LUBRICATING OIL COMPOSITION WITH REDUCED PHOSPHORUS LEVELS ALBEMARLE CORPORATION (US) 2006-10-05 WO disclosed
US-20060223724-A1 Lubricating oil composition with reduced phosphorus levels SI GROUP, INC. 2006-10-05 US disclosed
US-20040142814-A1 Organoaluminum catalyst UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC 2004-07-22 US disclosed
EP-1406726-A2 ORGANOALUMINIUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2004-04-14 EP disclosed
WO-2002098559-A2 ORGANOALUMINUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY COR PORATION (US) 2002-12-12 WO disclosed
EP-0269569-B1 ESTERIFICATION PROCESS WITH CALCIUM HYDROXYBENZYL PHOSPHONATE-PHENOL SULFIDE CATALYST SYSTEM CIBA-GEIGY AG (CH) 1992-05-13 EP disclosed
US-5012003-A Process for preparing dithiobisphenols CIBA-GEIGY CORPORATION (US) 1991-04-30 US disclosed
US-4898980-A Process for preparing dithiobisphenols CIBA-GEIGY CORPORATION (US) 1990-02-06 US disclosed
EP-0349488-A1 Process for preparing dithiobisphenols CIBA-GEIGY AG (CH) 1990-01-03 EP disclosed
US-4775497-A OXIDATION RESISTANCE, DISCOLORATION INHIBITION, AND STORAGE ST ABILITY CIBA-GEIGY CORPORATION (US) 1988-10-04 US disclosed
US-3991139-A NORBORNENE DERIVATIVES, PHENOLS, ESTER THIOETHERS SHOWA DENKO KABUSHIKI KAISHA (JA) 1976-11-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040142814-A1 Organoaluminum catalyst AHR, LBR, NR1H3 CA2 2841/4885CA1 2486/4885ALOX15 207/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.