Benzothiophene

Benzothiophene

SCHEMBL4083140

O=C1OC(=O)c2c1ccc1ccccc21.c1ccc2sccc2c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.41
MAPT P10636 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 6/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 2/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL29423627 0.84 DNMT1 (0.55) DNMT1MAPTMEN1KMT2AALDH1A1
SCHEMBL137604 0.84 DNMT1 (0.55) DNMT1MAPTMEN1KMT2AALDH1A1
SCHEMBL29262283 0.82 DNMT1 (0.53) DNMT1MAPTMEN1KMT2AALDH1A1
Phenanthrene SCHEMBL28161136 0.77 CYP2A6 (0.55) ALDH1A1CYP1A2HIF1ACA12CA9
Maleic Anhydride SCHEMBL29199820 0.76 DNMT1 (0.47) DNMT1MAPTMEN1KMT2AALDH1A1
SCHEMBL15119562 0.76 ALDH1A1 (0.59) DNMT1MAPTMEN1KMT2AALDH1A1
SCHEMBL4075535 0.74 DNMT1 (0.40) DNMT1MAPTMEN1KMT2AALDH1A1
Triphenylene SCHEMBL2841244 0.73 GPR3 (0.48) MAPTALDH1A1CYP1A2HPGDCA12
SCHEMBL7981169 0.73 TYMS (0.38) DNMT1TYMSALOX15TDP1
SCHEMBL7985135 0.73 TYMS (0.48) DNMT1MAPTMEN1KMT2AALDH1A1

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
CN-114702509-B Benzothiophene naphthalimide derivative and synthesis process and application thereof 浙江工业大学 2023-07-25 CN disclosed
CN-114702509-A Benzothienonaphthalimide derivative and synthesis process and application thereof 浙江工业大学 2022-07-05 CN disclosed
EP-1626050-B1 SULFUR-CONTAINING NAPHTHOYLIMIDE DERIVATIVES UNIV EAST CHINA SCIENCE & TECH (CN) 2009-12-02 EP disclosed
US-7541463-B2 Sulfur-containing naphthalimide derivatives EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2009-06-02 US disclosed
US-20080234287-A1 SULFUR-CONTAINING NAPHTHALIMIDE DERIVATIVES QIAN XUHONG 2008-09-25 US disclosed
US-20060111367-A1 Sulfur-containing naphthalimide derivatives SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCE (CN) 2006-05-25 US disclosed
EP-1626050-A1 SULFUR-CONTAINING NAPHTHOYLIMIDE DERIVATIVES East China University of Science and Technology (CN) 2006-02-15 EP 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 (2 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-20060111367-A1 Sulfur-containing naphthalimide derivatives HCCS, SQOR, MKI67 DNMT1 2041/4885MAPT 4558/4885MEN1 3613/4885
US-20080234287-A1 SULFUR-CONTAINING NAPHTHALIMIDE DERIVATIVES HCCS, SQOR, MKI67 DNMT1 2041/4885MAPT 4558/4885MEN1 3613/4885

“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.