SCHEMBL9713659

SCHEMBL9713659

S=Cc1ccccc1C=S

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NFE2L2 Q16236 3/20 0.38
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
BBOX1 O75936 1/20 0.32
EHMT2 Q96KQ7 1/20 0.32
EHMT1 Q9H9B1 1/20 0.32
CYP2A6 P11509 1/20 0.31
ALOX12 P18054 1/20 0.31
TRPA1 O75762 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL31735314 0.85 LMNA (0.72) MEN1LMNATHRBBLMKMT2A
SCHEMBL7561007 0.85 ALDH1A1 (0.50) MEN1LMNATHRBBLMKMT2A
SCHEMBL4572237 0.81
SCHEMBL18643102 0.81 NFE2L2 (0.33) MEN1LMNATHRBBLMKMT2A
SCHEMBL8128719 0.78
SCHEMBL195170 0.78
SCHEMBL6828181 0.78
SCHEMBL196275 0.78
SCHEMBL371078 0.78
SCHEMBL10678897 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268039-B1 3-TERT-BUTYL AND 3-TERT-BUTYL-5-ALKYL-4-HYDROXYPHENYL ALCANOID ACID ESTER WITH OXYETHYLATES OF POLYTHIOLS, PROCESS FOR THEIR PREPARATION AND USE AS STABILIZER HÜLS AKTIENGESELLSCHAFT (DE) 1992-09-02 EP claimed
US-4906775-A Esters of 3-tert-butyl- and 3-tert-butyl-5-alkyl-4-hydroxyphenyl (alkane) carboxylic acids with oxyethylates of polythiols HUELS AKTIENGESELLSCHAFT (DE) 1990-03-06 US claimed
EP-0268039-A2 3-Tert-butyl and 3-tert-butyl-5-alkyl-4-hydroxyphenyl alcanoid acid ester with oxyethylates of polythiols, process for their preparation and use as stabilizer HÜLS AKTIENGESELLSCHAFT (DE) 1988-05-25 EP claimed
US-3935198-A BY HEATING THE PENICILLIN SULFOXIDE YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) 1976-01-27 US claimed
US-20180226585-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-08-09 US disclosed
US-3935198-A BY HEATING THE PENICILLIN SULFOXIDE YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) 1976-01-27 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-20180226585-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS THEREOF PIEZO1, ORAI2, VDAC2 MEN1 1861/4885LMNA 1721/4885THRB 4748/4885

“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.