SCHEMBL725810

SCHEMBL725810

NC(=S)Nc1ccc(NC(N)=S)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.75
TAS2R38 P59533 2/20 0.75
TP53 P04637 1/20 0.75
TYR P14679 1/20 0.75
TSHR P16473 1/20 0.75
HSD17B10 Q99714 1/20 0.75
CYP3A4 P08684 1/20 0.73
CYP2D6 P10635 1/20 0.73
CYP2C9 P11712 1/20 0.73
HPGD P15428 1/20 0.73
ALOX12 P18054 1/20 0.73
CYP2C19 P33261 1/20 0.73
GAA P10253 3/20 0.67
KMT2A Q03164 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
MAPT P10636 2/20 0.67
KIF11 P52732 1/20 0.59
CYP1A2 P05177 1/20 0.52
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL12071790 0.89 ALDH1A1 (0.62) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL728343 0.89 ALDH1A1 (0.62) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL1822006 0.89 ALDH1A1 (0.65) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL652231 0.87 IDO1 (0.63) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL145719 0.87 IDO1 (0.63) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL449122 0.87 ALDH1A1 (0.60) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL5518697 0.87 IDO1 (0.63) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL11751583 0.87 ALDH1A1 (0.61) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL526059 0.87 MAPT (0.63) ALDH1A1TAS2R38TP53TYRTSHR
SCHEMBL1278440 0.87 ALDH1A1 (0.61) ALDH1A1TAS2R38TP53TYRTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005915-A Preparation method and application of lithium anode modified material 深圳欣界能源科技有限公司 2024-05-10 CN claimed
CN-117645338-A Method for degrading antibiotics in water body by using thiourea covalent organic framework photocatalyst 湖南大学 2024-03-05 CN claimed
CN-117488289-A Chemical nickel plating method 中新联科环境科技(安徽)有限公司 2024-02-02 CN claimed
CN-116130607-A Preparation method and application of solid sulfur anode 哈尔滨工业大学 2023-05-16 CN claimed
CN-108690584-B Composite profile control agent 中国石油天然气集团有限公司 2021-01-29 CN claimed
CN-109233778-B High-temperature antioxidant corrosion inhibitor for gas injection flooding injection well 中国石油天然气集团有限公司 2021-01-01 CN claimed
CN-108823570-B Environment-friendly anti-oxidation corrosion inhibitor for oilfield ground gathering and transportation pipeline and preparation method thereof 中国石油天然气集团有限公司 2020-11-06 CN claimed
CN-109518171-B Chemical nickel plating solution 广州传福化学技术有限公司 2020-10-27 CN claimed
CN-111733404-A Chemical nickel plating solution and preparation method thereof 广州皓悦新材料科技有限公司 2020-10-02 CN claimed
CN-108559979-B Chemical nickel plating solution and preparation method thereof 永星化工(上海)有限公司 2020-05-08 CN claimed
CN-108165959-B Chemical copper plating solution 永星化工(上海)有限公司 2020-02-07 CN claimed
US-20140058111-A1 PROCESS OF MANUFACTURING BENZOBISTHIAZOLE BUILDING BLOCKS FOR CONJUGATED POLYMERS PHILLIPS 66 COMPANY (US) 2014-02-27 US claimed
EP-1252172-A2 COMPOUND COMPRISING A PEPTIDE MOIETY AND AN ORGANO-SILANE MOIETY VBC-Genomics Bioscience Research GmbH (AT) 2002-10-30 EP claimed
EP-1250344-A2 COMPOUND COMPRISING A NUCLEIC ACID MOIETY AND AN ORGANO-SILANE MOIETY VBC-Genomics Bioscience Research GmbH (AT) 2002-10-23 EP claimed
WO-2001046214-A2 COMPOUND COMPRISING A NUCLEIC ACID MOIETY AND AN ORGANO-SILANE MOIETY VBC-GENOMICS BIOSCIENCE RESEARCH GMBH (AT) 2001-06-28 WO claimed
WO-2001046213-A2 COMPOUND COMPRISING A PEPTIDE MOIETY AND AN ORGANO-SILANE MOIETY. VBC-GENOMICS BIOSCIENCE RESEARCH GMBH (AT) 2001-06-28 WO claimed
EP-1110967-A1 Compound comprising a biomolecule moiety and an organo-silane moiety LION Bioscience AG (DE) 2001-06-27 EP claimed
JP-61268688-A None JP disclosed
US-4522745-A NITROGEN CONTAINING RING;POSSIBLY CONTAINING OXYGEN, SULFUR, SELENIUM OR TELLURIUM CHEVRON RESEARCH COMPANY (US) 1985-06-11 US disclosed
JP-S57167-A ELECTRICALLY CONDUCTIVE RESIN COMPOSITION FOR ELECTROPLATING TOKYO INK KK 1982-01-05 JP 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-20140058111-A1 PROCESS OF MANUFACTURING BENZOBISTHIAZOLE BUILDING BLOCKS FOR CONJUGATED POLYMERS CYP1B1, TUBB4B, DDC ALDH1A1 215/4885TAS2R38 1041/4885TP53 4370/4885

“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.