SCHEMBL337883

SCHEMBL337883

OCCc1ccccc1S

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
PTPN1 P18031 2/20 0.35
MAPT P10636 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
FOLH1 Q04609 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HSPA5 P11021 1/20 0.33
FFAR1 O14842 1/20 0.33
MDM4 O15151 1/20 0.32
TP53 P04637 1/20 0.32
KMT2A Q03164 1/20 0.32
CA2 P00918 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
IDO1 P14902 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
SCHEMBL30444664 1.00 TDP1 (0.44) TDP1PTPN1MAPTHDAC8APOBEC3G
SCHEMBL10682655 0.86 POLB (0.38) TDP1MAPTHDAC8APOBEC3GCA2
SCHEMBL5174795 0.84 IDO1 (0.36) MAPTHDAC8FOLH1TAAR1HSPA5
SCHEMBL29534868 0.81 TDP1 (0.55) TDP1PTPN1APOBEC3GTAAR1HSPA5
SCHEMBL31203 0.81 TDP1 (0.55) TDP1PTPN1APOBEC3GTAAR1HSPA5
SCHEMBL27952236 0.79 LIPG (0.34) MAPTHDAC8FOLH1TAAR1IDO1
SCHEMBL423675 0.79
SCHEMBL2641641 0.78 TDP1 (0.33) TDP1TAAR1
SCHEMBL27985437 0.77 FOLH1 (0.48) FOLH1TAAR1IDO1
SCHEMBL27457207 0.77 APOBEC3G (0.46) TDP1MAPTHDAC8APOBEC3GHSPA5

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4122258-A Process for producing desacetoxycephalosporin derivatives by heating a penicillin-1-oxide in presence of an organic sulfide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1978-10-24 US claimed
CN-110944629-B Enzyme-triggered carbon monoxide release molecules 乔治亚州立大学研究基金会股份有限公司 2024-04-09 CN disclosed
EP-3638222-B1 ENZYME-TRIGGERED CARBON MONOXIDE RELEASING MOLECULES UNIV GEORGIA STATE RES FOUND (US) 2024-04-03 EP disclosed
CN-111393683-B Modified cationic microgel and preparation method and application thereof 广东科德环保科技股份有限公司 2023-05-23 CN disclosed
US-11377435-B2 Enzyme-triggered carbon monoxide releasing molecules GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-07-05 US disclosed
US-20200392498-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS SOLSTICE BIOLOGICS LTD (IE) 2020-12-17 US disclosed
WO-2020155595-A1 AEROBIC OXIDATION SYSTEM CONTAINING SULFINIC ACID, SULFONIC ACID OR DERIVATIVES THEREOF AND PHOTOCATALYTIC OXIDATION METHOD THEREFOR 清华大学 2020-08-06 WO disclosed
EP-3638222-A1 ENZYME-TRIGGERED CARBON MONOXIDE RELEASING MOLECULES Georgia State University Research Foundation, Inc. (US) 2020-04-22 EP disclosed
US-20200115360-A1 ENZYME-TRIGGERED CARBON MONOXIDE RELEASING MOLECULES GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC, 2020-04-16 US disclosed
CN-110944629-A Enzyme-triggered carbon monoxide releasing molecules 乔治亚州立大学研究基金会股份有限公司 2020-03-31 CN disclosed
WO-2002100860-A2 HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING SAME AND USE THEREOF AS MEDICINES, IN PARTICULAR AS ANTI-BACTERIAL AGENTS AVENTIS PHARMA S.A. (FR) 2002-12-19 WO disclosed
EP-0822936-A1 NOVEL SUBSTITUTED TETRAHYDROPYRANO 3,2-d]OXAZOLONES, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1998-02-11 EP disclosed
WO-1996033999-A1 NOVEL SUBSTITUTED TETRAHYDROPYRANO[3,2-d]OXAZOLONES, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1996-10-31 WO disclosed
US-5177211-A Anti-platelet aggregation and anti-hypotensive ALTER, S.A. (ES) 1993-01-05 US disclosed
EP-0325187-B1 4-ALKYL-1, 4-DIHYDROPYRIDINES WITH PAF-ANTAGONIST ACTIVITY ALTER, S.A. (ES) 1992-11-11 EP disclosed
EP-0325187-A1 4-alkyl-1, 4-dihydropyridines with PAF-antagonist activity ALTER, S.A. (ES) 1989-07-26 EP disclosed
EP-0060799-B1 DIESTER ANTIOXIDANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-06-06 EP disclosed
US-4246267-A HYPOTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-01-20 US disclosed
US-4122258-A Process for producing desacetoxycephalosporin derivatives by heating a penicillin-1-oxide in presence of an organic sulfide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1978-10-24 US disclosed
US-4108831-A FOR CONJUGATED DIENE POLYMERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-08-22 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 (3 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-11377435-B2 Enzyme-triggered carbon monoxide releasing molecules CNDP2, CPN1, JMJD7 TDP1 973/4885PTPN1 3711/4885MAPT 4628/4885
US-20200392498-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 TDP1 495/4885PTPN1 1980/4885MAPT 4716/4885
US-20200115360-A1 ENZYME-TRIGGERED CARBON MONOXIDE RELEASING MOLECULES CNDP2, CPN1, JMJD7 TDP1 1043/4885PTPN1 3731/4885MAPT 4628/4885

“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.