SCHEMBL37551

SCHEMBL37551

CCCCCCCCNCC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.77
ALDH1A1 P00352 1/20 0.71
CYP2C19 P33261 2/20 0.67
CYP1A2 P05177 1/20 0.67
MEN1 O00255 1/20 0.61
GLA P06280 1/20 0.61
KMT2A Q03164 1/20 0.61
KDM1A O60341 5/20 0.59
EPHX1 P07099 2/20 0.55
ADH1B P00325 1/20 0.55
ADH1C P00326 1/20 0.55
ADH1A P07327 1/20 0.55
ADH4 P08319 1/20 0.55
ADH7 P40394 1/20 0.55
THRB P10828 1/20 0.50
S1PR2 O95136 5/20 0.48
S1PR4 O95977 5/20 0.48
S1PR1 P21453 5/20 0.48
S1PR3 Q99500 5/20 0.48
S1PR5 Q9H228 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
SCHEMBL148324 1.00
SCHEMBL75273 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL20799545 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL24742546 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL25177470 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL25203963 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL25184850 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL25198169 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL21611661 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1
SCHEMBL37304 1.00 TSHR (0.77) TSHRALDH1A1CYP2C19CYP1A2MEN1

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 1608 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3476826-B1 ISOCYANATE POLYMERIZATION CATALYST, MANUFACTURING METHOD THEREOF, AND METHOD FOR USING THE CATALYST FOR MANUFACTURING POLYISOCYANATE WANHUA CHEMICAL GROUP CO LTD (CN) 2022-09-28 EP claimed
US-11111332-B2 Isocyanate polymerization catalyst, preparation method thereof, and method for preparing polyisocyanate by using same WANHUA CHEMICAL GROUP CO., LTD. 2021-09-07 US claimed
CN-108123175-B Synthesis method of amide compound, amide compound and non-aqueous electrolyte 微宏动力系统(湖州)有限公司 2020-05-22 CN claimed
US-20200123300-A1 Isocyanate Polymerization Catalyst, Preparation Method Thereof, And Method For Preparing Polyisocyanate By Using Same WANHUA CHEMICAL GROUP CO., LTD. (CN) 2020-04-23 US claimed
CN-107021920-B A kind of isocyanate polymeric catalyst and preparation method thereof, and its method for being used to prepare polyisocyanate 万华化学集团股份有限公司 2019-07-23 CN claimed
EP-3476826-A1 ISOCYANATE POLYMERIZATION CATALYST, MANUFACTURING METHOD THEREOF, AND METHOD FOR USING THE CATALYST FOR MANUFACTURING POLYISOCYANATE Wanhua Chemical Group Co., Ltd. (CN) 2019-05-01 EP claimed
US-10113049-B2 Thermoplastic resin composition NIPPON NYUKAZAI CO., LTD. (JP) 2018-10-30 US claimed
CN-108123175-A For the synthetic method of the amide compound of lithium secondary cell electrolyte, amide compound and nonaqueous electrolytic solution 微宏动力系统(湖州)有限公司 2018-06-05 CN claimed
EP-2943067-B1 FUNGICIDAL COMPOSITION UPL LTD (IN) 2018-05-30 EP claimed
US-20170306096-A1 MOISTURE CURABLE COMPOSITIONS MOMENTIVE PERFORMANCE MATERIALS INC. 2017-10-26 US claimed
EP-1469125-A1 Wet strength and softness enhancement of paper products Fort James Corporation (US) 2004-10-20 EP claimed
EP-0672739-B1 THERMOREVERSIBLE THICKENER SANYO CHEMICAL IND LTD (JP) 2001-01-03 EP claimed
US-5658981-A WITH WATER SOLUBLE POLYMER THAT CONTAINS MONOMER THAT IS THE REACTION PRODUCT OF A POLYALKYLENE OXIDE, A CYCLIC OR ACYCLIC AMINE AND AN UNSATURATED ACID, OPTIONALLY CONTAINING A COMONOMER SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1997-08-19 US claimed
EP-0497926-A1 MULTI-SITE METAL CHELATING AGENTS NYCOMED SALUTAR, INC. (US) 1992-08-12 EP claimed
EP-0486656-A1 COMPOSITION FOR INHIBITING STRESS CRACKS IN PLASTIC ARTICLES AND METHODS OF USE THEREFOR. DIVERSEY CORP (CA) 1992-05-27 EP claimed
US-5073280-A Amine lubricant, conveying, bottles DIVERSEY CORPORATION (CA) 1991-12-17 US claimed
WO-1991018943-A1 COMPOSITION FOR INHIBITING STRESS CRACKS IN PLASTIC ARTICLES AND METHODS OF USE THEREFOR DIVERSEY CORPORATION (CA) 1991-12-12 WO claimed
WO-1991005762-A1 MULTI-SITE METAL CHELATING AGENTS COCKBAIN, JULIAN, RODERICK, MICHAELSON (GB) 1991-05-02 WO claimed
US-4726835-A Herbicidal and plant growth regulating imidazoline derivatives IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-02-23 US claimed
US-4430513-A COBALT OR RHODIUM CARBONYL, CARBON-CARBON BOND FORMATION UOP INC. (US) 1984-02-07 US 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 (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-20170306096-A1 MOISTURE CURABLE COMPOSITIONS DOT1L, EHMT2, CDH1 TSHR 4580/4885ALDH1A1 595/4885CYP2C19 2805/4885

“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.