SCHEMBL1736341

SCHEMBL1736341

CCN(CC)CC.CCN(CC)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
MGLL Q99685 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
MEN1 O00255 2/20 0.33
POLB P06746 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
APEX1 P27695 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
MCL1 Q07820 1/20 0.33
HKDC1 Q2TB90 1/20 0.33

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
SCHEMBL124190 1.00
SCHEMBL30 1.00
SCHEMBL3466974 0.94
Water SCHEMBL812317 0.94 ALDH1A1 (0.36) ALDH1A1MGLLHRH3MEN1POLB
SCHEMBL742858 0.94
Bromide SCHEMBL328981 0.94
SCHEMBL1334883 0.94
Fluoride SCHEMBL22345959 0.94 ALDH1A1 (0.36) ALDH1A1MGLLHRH3MEN1POLB
Water SCHEMBL20920097 0.94 ALDH1A1 (0.36) ALDH1A1MGLLHRH3MEN1POLB
Hydrochloric Acid SCHEMBL5047658 0.94 ALDH1A1 (0.36) ALDH1A1MGLLHRH3MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109942609-B Peroxynitrite near-infrared fluorescent probe ONP, and preparation method and application thereof 南京师范大学 2021-06-01 CN claimed
CN-108872405-A A kind of HPLC analyzing detecting method of the lodoxamide tromethamine in relation to substance 武汉先路医药科技股份有限公司 2018-11-23 CN claimed
CN-105820724-B A kind of polyphosphazene composite utility coating of automobile using high fire-retardance scratch-resistant 上海新泊地化工技术服务有限公司 2018-05-11 CN claimed
CN-107858178-A A kind of oil emulsion of Effictive nuisancelless and preparation method thereof 深圳市国能环保科技有限公司 2018-03-30 CN claimed
CN-106699591-A Clean production process of glycine and co-produced ammonium chloride 青岛森美克化工技术有限公司 2017-05-24 CN claimed
CN-101104615-A Anticancer cytoskeleton inhibiting and cell elongation inducing compound and synthesis method thereof CHEN ZHENGSHU (CN) 2008-01-16 CN claimed
WO-2024120424-A1 COMPOUND TARGETING PAN-KRAS PROTEIN DEGRADATION AGENT AND USE THEREOF 贝达药业股份有限公司 2024-06-13 WO disclosed
US-20240156788-A1 SUBSTITUTED 2-AMINOBENZIMIDAZOLES ANALOGS AS ANTIBIOFILM AGENTS NORTH CAROLINA STATE UNIVERSITY 2024-05-16 US disclosed
US-11883384-B2 Substituted 2-aminobenzimidazoles analogs as antibiofilm agents OHIO STATE INNOVATION FOUNDATION (US) 2024-01-30 US disclosed
US-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-12-07 US disclosed
EP-4259798-A1 POLY-MORPHOLINO OLIGONUCLEOTIDE GAPMERS Eisai R&D Management Co., Ltd. (JP) 2023-10-18 EP disclosed
US-20230322722-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN NALO THERAPEUTICS (US) 2023-10-12 US disclosed
EP-4247551-A1 DEHYDRATION OF LACTIC ACID AND RELATED COMPOUNDS IN SOLID ACIDS VIA MULTIFUNCTIONAL FLEXIBLE MODIFIERS Regents of the University of Minnesota (US) 2023-09-27 EP disclosed
WO-1998059105-A2 SURFACTANTS FOR USE IN DRYING AND DRY CLEANING COMPOSITIONS ALLIEDSIGNAL INC. (US) 1998-12-30 WO disclosed
US-5662802-A TRIETYLAMINE IONICS, INCORPORATED (US) 1997-09-02 US disclosed
US-5530150-A HAVING PHOSPHINE AND PHOSPHITE GROUPS IN SAME MOLECULE; CATALYST SELECTIVITY TAKASAGO INTERNATIONAL CORPORATION (JP) 1996-06-25 US disclosed
US-5364977-A Chemical stabilization and powder processing NIPPON SODA CO., LTD. (JP) 1994-11-15 US disclosed
CN-1094727-A The 5-(hetero) aryl indole derivatives PFIZER (US) 1994-11-09 CN disclosed
CN-1012069-B Aqueous coating agent, method for the production thereof and use thereof as coating for cans BASF LACKE & FARBEN (DE) 1991-03-20 CN disclosed
US-4223070-A COATING FIRST WITH A LIQUID AND A POLYISOCYANATE THEN AN AQUEOUS SOLUTION OF A POLYMERIZATION CATALYST STAUFFER CHEMICAL COMPANY (US) 1980-09-16 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 (4 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-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF CYP11B2, SDHA, UGT2B7 ALDH1A1 241/4885MGLL 3645/4885HRH3 1094/4885
US-20230322722-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN MYC, MYCBP, MYCBP2 ALDH1A1 4067/4885MGLL 3750/4885HRH3 4228/4885
US-11883384-B2 Substituted 2-aminobenzimidazoles analogs as antibiofilm agents ITGB3, ITGB2, ITGAM ALDH1A1 2187/4885MGLL 1598/4885HRH3 3954/4885
US-20240156788-A1 SUBSTITUTED 2-AMINOBENZIMIDAZOLES ANALOGS AS ANTIBIOFILM AGENTS ITGB3, ITGB2, ITGAM ALDH1A1 2187/4885MGLL 1598/4885HRH3 3954/4885

“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.