SCHEMBL4140633

SCHEMBL4140633

C=CCN(CCCCC)CCCCC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
ALDH1A1 P00352 1/20 0.42
DNM1 Q05193 3/20 0.40
KCNH2 Q12809 6/20 0.36
FAAH O00519 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
THRB P10828 1/20 0.33
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL28760238 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL28485740 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL6159782 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL8423278 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL8421983 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL11233672 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL22157373 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL22157437 0.98 TSHR (0.42) TSHRALDH1A1DNM1KCNH2FAAH
Hydrochloric Acid SCHEMBL22771836 0.98 TSHR (0.42) TSHRALDH1A1DNM1KCNH2FAAH
SCHEMBL2156532 0.98 TSHR (0.48) TSHRALDH1A1DNM1KCNH2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2861670-B1 METAL FREE REACTIVE DYES, PROCESS FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2017-08-16 EP claimed
EP-3039083-B1 DYE MIXTURES OF METAL-FREE REACTIVE DYES, PRODUCTION AND USE DYSTAR COLOURS DISTRIB GMBH (DE) 2017-06-07 EP claimed
EP-3884019-B1 HOME CARE COMPOSITIONS COLGATE PALMOLIVE CO (US) 2025-09-03 EP disclosed
EP-3884019-A1 HOME CARE COMPOSITIONS Colgate-Palmolive Company (US) 2021-09-29 EP disclosed
CN-113227340-A Home care compositions 高露洁-棕榄公司 2021-08-06 CN disclosed
US-11008533-B2 Home care compositions COLGATE-PALMOLIVE COMPANY (US) 2021-05-18 US disclosed
WO-2020139335-A1 HOME CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2020-07-02 WO disclosed
US-20200208081-A1 HOME CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2020-07-02 US disclosed
CN-110981786-A 2-arylvinyl-cyclic amine derivative and preparation method and application thereof 泰州医药城国科化物生物医药科技有限公司 2020-04-10 CN disclosed
CN-110981787-A 2- (2, 2-diaryl vinyl) -quaternary ammonium salt type cyclic amine derivative and preparation method thereof 泰州医药城国科化物生物医药科技有限公司 2020-04-10 CN disclosed
CN-110240559-A 2-(2,2- diarylethene base) Cycloamine derivative and preparation method thereof 泰州医药城国科化物生物医药科技有限公司 2019-09-17 CN disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7157198-B2 Toner for electrostatic latent image development and an image forming method KONICA MINOLTA HOLDINGS, INC (JP) 2007-01-02 US disclosed
US-20060094706-A1 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION 2006-05-04 US disclosed
US-20050214665-A1 Toner for electrostatic latent image development and an image forming method KONICA MINOLTA HOLDINGS, INC. (JP) 2005-09-29 US disclosed
EP-1511751-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS Neogenesis Pharmaceuticals, Inc. (US) 2005-03-09 EP disclosed
US-20040038993-A1 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents NEOGENESIS PHARMACEUTICALS, INC. 2004-02-26 US disclosed
WO-2003101993-A1 PYRAZOLO` 1,5A! PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS NEOGENESIS PHARMACEUTICALS, INC. (US) 2003-12-11 WO disclosed
US-20030194629-A1 Production apparatus of toner for developing electrostatic images, production method thereof, and toner for developing electrostatic images KONICA CORPORATION (JP) 2003-10-16 US disclosed
US-5760091-A ADDING TO SEAWATER SYSTEM AN AMINE COMPOUND AND A POLYAMINE COMPOUND KATAYAMA CHEMICAL, INC. (JP) 1998-06-02 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 (2 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-20040038993-A1 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents RNGTT, PNP, ZC3HAV1 TSHR 4412/4885ALDH1A1 482/4885DNM1 1976/4885
US-20060094706-A1 Pyrazolopyrimidines as protein kinase inhibitors CDKN1A, EIF2AK2, DCK TSHR 4206/4885ALDH1A1 1771/4885DNM1 3153/4885

“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.