SCHEMBL443909

SCHEMBL443909

Sc1ccc(C=Cc2ccc(S)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.42
NFE2L2 Q16236 3/20 0.39
CYP19A1 P11511 3/20 0.39
MAOB P27338 3/20 0.39
MAOA P21397 2/20 0.39
APP P05067 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
CYP2C19 P33261 3/20 0.38
HSD17B10 Q99714 3/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA13 Q8N1Q1 2/20 0.38

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
SCHEMBL443908 1.00 IDO1 (0.42) IDO1NFE2L2CYP19A1MAOBMAOA
SCHEMBL9680702 1.00 IDO1 (0.42) IDO1NFE2L2CYP19A1MAOBMAOA
SCHEMBL9680696 1.00 IDO1 (0.42) IDO1NFE2L2CYP19A1MAOBMAOA
SCHEMBL28525460 0.88 MAOB (0.56) NFE2L2CYP19A1MAOBMAOAMEN1
SCHEMBL13363600 0.87 APP (0.50) IDO1NFE2L2CYP19A1MAOBMAOA
SCHEMBL14646385 0.86 NFE2L2 (0.58) NFE2L2CA1KDM4ECYP1A2CYP3A4
SCHEMBL13429892 0.86 CYP2C19 (0.50) ALDH1A1HPGDCYP2C19KDM4EMEN1
SCHEMBL13478212 0.86 NFE2L2 (0.58) NFE2L2CA1KDM4ECYP1A2CYP3A4
SCHEMBL9680249 0.86 IDO1 (0.68) IDO1NFE2L2MAOBALDH1A1HSD17B10
SCHEMBL18843955 0.86 NFE2L2 (0.61) NFE2L2APPALOX5NQO2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12187851-B2 Network polymers and methods of making and using same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2025-01-07 US claimed
US-12054607-B2 Tough, healable composites displaying stress relaxation at the resin-filler interface THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2024-08-06 US claimed
US-20230119934-A1 NETWORK POLYMERS AND METHODS OF MAKING AND USING SAME UNIV COLORADO REGENTS (US) 2023-04-20 US claimed
CN-114907527-B Water-based fracturing fluid thickening agent and preparation method thereof 山东诺尔生物科技有限公司 2022-09-13 CN claimed
CN-114907527-A Water-based fracturing fluid thickening agent and preparation method thereof 山东诺尔生物科技有限公司 2022-08-16 CN claimed
CN-113817173-B Variable-rigidity self-repairing material containing metal-mercapto coordination bond and preparation and application thereof 南京大学 2022-07-12 CN claimed
CN-113817173-A Variable-rigidity self-repairing material containing metal-mercapto coordination bond and preparation and application thereof 南京大学 2021-12-21 CN claimed
US-20210292482-A1 NETWORK POLYMERS AND METHODS OF MAKING AND USING SAME THE REGENTS OF THE UNIV OF COLORADO A BODY CORPORTATE (US) 2021-09-23 US claimed
US-20210002469-A1 TOUGH, HEALABLE COMPOSITES DISPLAYING STRESS RELAXATION AT THE RESIN-FILLER INTERFACE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-01-07 US claimed
WO-2019183140-A1 TOUGH, HEALABLE COMPOSITES DISPLAYING STRESS RELAXATION AT THE RESIN-FILLER INTERFACE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2019-09-26 WO claimed
US-9408393-B2 Bismuth-thiols as antiseptics for agricultural, industrial and other uses MICROBION CORPORATION (US) 2016-08-09 US claimed
US-8951446-B2 Hybrid particles and associated methods BATTELLE ENERGY ALLIANCE, LLC (US) 2015-02-10 US claimed
US-8816021-B2 Curable composition with rubber-like properties DESIGNER MOLECULES, INC. (US) 2014-08-26 US claimed
US-20130224258-A1 BISMUTH-THIOLS AS ANTISEPTICS FOR AGRICULTURAL, INDUSTRIAL AND OTHER USES MICROBION CORPORATION (US) 2013-08-29 US claimed
US-20130200313-A1 HYBRID PARTICLES AND ASSOCIATED METHODS BATTELLE ENERGY ALLIANCE, LLC (US) 2013-08-08 US claimed
EP-2603083-A2 BISMUTH-THIOLS AS ANTISEPTICS FOR AGRICULTURAL, INDUSTRIAL AND OTHER USES Microbion Corporation (US) 2013-06-19 EP claimed
EP-2536406-A2 BISMUTH-THIOLS AS ANTISEPTICS FOR BIOMEDICAL USES, INCLUDING TREATMENT OF BACTERIAL BIOFILMS AND OTHER USES Microbion Corporation (US) 2012-12-26 EP claimed
US-20120065336-A1 CURABLE COMPOSITION WITH RUBBER-LIKE PROPERTIES DESIGNER MOLECULES, INC. (US) 2012-03-15 US claimed
WO-2012021754-A2 BISMUTH-THIOLS AS ANTISEPTICS FOR AGRICULTURAL, INDUSTRIAL AND OTHER USES MICROBION CORPORATION (US) 2012-02-16 WO claimed
WO-2011097347-A2 BISMUTH-THIOLS AS ANTISEPTICS FOR BIOMEDICAL USES, INCLUDING TREATMENT OF BACTERIAL BIOFILMS AND OTHER USES MICROBION CORPORATION (US) 2011-08-11 WO claimed

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-12054607-B2 Tough, healable composites displaying stress relaxation at the resin-filler interface CRH, CNKSR1, RAD51 IDO1 882/4885NFE2L2 4189/4885CYP19A1 4776/4885
US-20210002469-A1 TOUGH, HEALABLE COMPOSITES DISPLAYING STRESS RELAXATION AT THE RESIN-FILLER INTERFACE CRH, CNKSR1, RAD51 IDO1 882/4885NFE2L2 4189/4885CYP19A1 4776/4885
US-20130224258-A1 BISMUTH-THIOLS AS ANTISEPTICS FOR AGRICULTURAL, INDUSTRIAL AND OTHER USES TST, BTD, BTF3 IDO1 498/4885NFE2L2 3319/4885CYP19A1 4315/4885

“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.