SCHEMBL3595385

SCHEMBL3595385

O=[C]c1cnc(Cl)nc1Cl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
PIN1 Q13526 1/20 0.35
TYRO3 Q06418 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
KDM4E B2RXH2 1/20 0.32
JUN P05412 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31

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
SCHEMBL5677074 0.78 CSNK1A1 (0.41) CSNK1A1CLK4PIN1TYRO3DYRK1B
SCHEMBL5674151 0.78 CYP1A2 (0.35)
SCHEMBL14667068 0.77 CSNK1A1 (0.44) CSNK1A1CLK4PIN1TYRO3DYRK1B
SCHEMBL29724139 0.77 CSNK1A1 (0.64) CSNK1A1CLK4PIN1
SCHEMBL9043 0.77 CSNK1A1 (0.64) CSNK1A1CLK4PIN1
SCHEMBL2896218 0.74
SCHEMBL1163938 0.71 CSNK1A1 (0.39) CSNK1A1CLK4PIN1KDM4E
SCHEMBL5677422 0.70 TP53 (0.40)
SCHEMBL22578716 0.70 CSNK1A1 (0.38) CSNK1A1CLK4PIN1
SCHEMBL1688394 0.68 TYRO3 (0.34) CSNK1A1CLK4PIN1TYRO3DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0131545-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1988-04-20 EP claimed
EP-0130711-B1 AQUEOUS SOLUTIONS OF REACTIVE DYES ICI AMERICAS INC. (US) 1987-02-11 EP claimed
EP-0179019-A1 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1986-04-23 EP claimed
US-4560388-A WITH SULFO GROUP CONTAINING FIBER REACTIVE DYE CIBA-GEIGY CORPORATION (US) 1985-12-24 US claimed
US-4544738-A FIBER-REACTIVE YELLOW AND ORANGE DYES BASF AKTIENGESELLSCHAFT (DE) 1985-10-01 US claimed
EP-0130711-A2 Aqueous solutions of reactive dyes ICI AMERICAS INC. (US) 1985-01-09 EP claimed
US-4472168-A STORAGE STABILITY BUFFERED SOLUTIONS ICI AMERICAS INC. (US) 1984-09-18 US claimed
US-3933785-A Azo compounds CIBA-GEIGY AG (CH) 1976-01-20 US claimed
CN-117836299-A Novel bifunctional heterocyclic compounds with Bruton tyrosine kinase decomposition via ubiquitin proteasome pathway and uses thereof 韩国化学研究院 2024-04-05 CN disclosed
WO-2022270994-A1 NOVEL BIFUNCTIONAL HETEROCYCLIC COMPOUND HAVING BTK DEGRADATION FUNCTION VIA UBIQUITIN PROTEASOME PATHWAY, AND USE THEREOF 한국화학연구원 2022-12-29 WO disclosed
CN-107406452-A Pyrazolo [3,4 d] pyrimidine derivatives and its purposes for treating leishmaniasis 葛兰素史密斯克莱知识产权发展有限公司 2017-11-28 CN disclosed
US-7704996-B2 Compounds and compositions useful as cathepsin S inhibitors NOVARTIS AG (CH) 2010-04-27 US disclosed
US-20090048230-A1 COMPOUNDS AND COMPOSITIONS USEFUL AS CATHEPSIN S INHIBITORS NOVARTIS AG (CH) 2009-02-19 US disclosed
US-20060107869-A1 Inks for digital textile printing with reactive yellow fluorescent dyes DYSTAR TEXTILF DEUTSCHLAND KG (DE) 2006-05-25 US disclosed
US-4049704-A AZO REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed
US-3989692-A PHTHALOCYANINE DYES, WOOL, SILK, POLYAMIDES, CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-11-02 US disclosed
US-3988310-A FIBER-REACTIVE DYES; CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-10-26 US disclosed
US-3971738-A Heavy metal complexes of azo compounds containing a halogeno-2,3-dihydroxy pyridine coupling component CIBA-GEIGY AG (CH) 1976-07-27 US disclosed
US-3957751-A WATER-SOLUBLE REACTIVE DYESTUFFS OF THE MONOAZO SERIES CONTAINING AN ACTIVE METHYLENE COUPLING COMPONENT HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed
US-3933785-A Azo compounds CIBA-GEIGY AG (CH) 1976-01-20 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-20060107869-A1 Inks for digital textile printing with reactive yellow fluorescent dyes IK, COL1A1, DDX41 CSNK1A1 1720/4885CLK4 2936/4885PIN1 3611/4885
US-20090048230-A1 COMPOUNDS AND COMPOSITIONS USEFUL AS CATHEPSIN S INHIBITORS CTSS, CTSZ, CTSF CSNK1A1 77/4885CLK4 1269/4885PIN1 1244/4885

“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.