SCHEMBL3910230

SCHEMBL3910230

CCC(c1ccccn1)c1ccccn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
SLC6A2 P23975 6/20 0.58
SLC6A4 P31645 6/20 0.58
CHRM2 P08172 6/20 0.58
SCN1A P35498 3/20 0.58
SCN2A Q99250 3/20 0.58
SCN3A Q9NY46 3/20 0.58
SLC6A3 Q01959 5/20 0.54
KCNH2 Q12809 5/20 0.53
KCNA5 P22460 2/20 0.53
ALDH1A1 P00352 2/20 0.51
CYP1A2 P05177 1/20 0.51
CHRM1 P11229 5/20 0.50
HRH1 P35367 4/20 0.50
HRH3 Q9Y5N1 4/20 0.50
CYP2D6 P10635 3/20 0.50
ADRA2B P18089 3/20 0.50
HTR2A P28223 3/20 0.50
CHRM5 P08912 3/20 0.50
NFKB1 P19838 2/20 0.50

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
SCHEMBL17071880 0.90 SLC6A2 (0.67) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL290075 0.90 SLC6A2 (0.67) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL8090850 0.85 SLC6A2 (0.57) TSHRSLC6A2SLC6A4CHRM2SCN1A
Dimethylamine SCHEMBL28881499 0.85 SLC6A2 (0.61) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL23969993 0.83 KCNH2 (0.55) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL29520435 0.82 TSHR (0.62) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL65284 0.82 TSHR (0.62) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL11736090 0.82 CHRM2 (0.71) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL21911307 0.82 SLC6A2 (0.54) TSHRSLC6A2SLC6A4CHRM2SCN1A
SCHEMBL8797881 0.82 TSHR (0.50) TSHRSLC6A2SLC6A4CHRM2SCN1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109996785-A Copper deposition in wafer level packaging of integrated circuits 麦克德米德乐思公司 2019-07-09 CN claimed
EP-3195708-A1 LEVELERS FOR COPPER DEPOSITION IN MICROELECTRONICS MACDERMID ENTHONE INC. (US) 2017-07-26 EP claimed
CN-101573425-B CMP slurry composition for forming metal wire LG CHEMICAL LTD 2013-03-20 CN claimed
CN-101573425-A CMP slurry composition for forming metal wire LG CHEMICAL LTD (KR) 2009-11-04 CN claimed
US-20070219280-A1 Organometallic Complex Structure and Production Method Thereof; and Functional Film, Functional Composite Material, Functional Structure and Adsorption and Desorption Sensor Using the Organometallic Complex Structure KYOTO UNIVERSITY (JP) 2007-09-20 US claimed
US-6946298-B2 Karl fischer reagent SIGMA-ALDRICH CO. (US) 2005-09-20 US claimed
US-20020127726-A1 Karl fischer reagent SIGMA-ALDRICH CO. 2002-09-12 US claimed
EP-3904330-A1 ETHYLENEDIAMINE COMPOUND AND USE THEREOF Academy Of Military Medical Sciences (CN) 2021-11-03 EP disclosed
WO-2020135569-A1 ETHYLENEDIAMINE COMPOUND AND USE THEREOF 中国人民解放军军事科学院军事医学研究院 2020-07-02 WO disclosed
CN-101573425-B CMP slurry composition for forming metal wire LG CHEMICAL LTD 2013-03-20 CN disclosed
CN-101573425-A CMP slurry composition for forming metal wire LG CHEMICAL LTD (KR) 2009-11-04 CN disclosed
EP-1207389-B2 Karl-Fischer-Reagent SIGMA ALDRICH LABORCHEMIKALIEN (DE) 2009-02-18 EP disclosed
US-20070219280-A1 Organometallic Complex Structure and Production Method Thereof; and Functional Film, Functional Composite Material, Functional Structure and Adsorption and Desorption Sensor Using the Organometallic Complex Structure KYOTO UNIVERSITY (JP) 2007-09-20 US disclosed
US-6946298-B2 Karl fischer reagent SIGMA-ALDRICH CO. (US) 2005-09-20 US disclosed
US-20020127726-A1 Karl fischer reagent SIGMA-ALDRICH CO. 2002-09-12 US disclosed
EP-1207389-A1 Karl-Fischer-Reagent Sigma-Aldrich Laborchemikalien GmbH (DE) 2002-05-22 EP disclosed
EP-0933634-A2 Karl-Fischer reagent comprising ethanol as alcoholic component Rdh Laborchemikalien GmbH & Co. KG (DE) 1999-08-04 EP disclosed
CN-1018821-B improved process for preparing elastomeric coatings on fibers GOODRICH CO B F (US) 1992-10-28 CN disclosed
CN-1065076-A The carbonyl bearing polymer composition of water-dispersion GOODRICH CO B F (US) 1992-10-07 CN disclosed
CN-1037915-A An improved process for preparing an elastomeric coating on fibers and a water-dispersible polymer composition, GOODRICH CO B F (US) 1989-12-13 CN 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-20020127726-A1 Karl fischer reagent MASTL, KARS1, DOT1L TSHR 3455/4885SLC6A2 3146/4885SLC6A4 3434/4885

“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.