SCHEMBL4423724

SCHEMBL4423724

CCCN1CCN(CC)C1=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
FKBP1A P62942 1/20 0.36
F2 P00734 1/20 0.36
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36
CTRC Q99895 1/20 0.36
PER2 O15055 3/20 0.35
CRY2 Q49AN0 1/20 0.35
POLB P06746 1/20 0.34
ALOX15 P16050 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A1 P04798 1/20 0.33
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
DRD3 P35462 1/20 0.32
KCNH2 Q12809 1/20 0.32
GAA P10253 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
SCHEMBL609688 0.93 L3MBTL1 (0.42) L3MBTL1FKBP1AF2ELANECTSG
SCHEMBL329869 0.87 F2 (0.45) L3MBTL1F2ELANECTSGCTRC
SCHEMBL4433517 0.86 MEN1 (0.41) L3MBTL1F2ELANECTSGCTRC
SCHEMBL7044546 0.84 MEN1 (0.42) L3MBTL1FKBP1ASMN1; SMN2CYP1A1GAA
SCHEMBL8773329 0.84 POLB (0.47) L3MBTL1POLBDRD3KCNH2
SCHEMBL8089341 0.83 FKBP1A (0.41) L3MBTL1FKBP1AF2ELANECTSG
SCHEMBL10416569 0.83 FKBP1A (0.41) L3MBTL1FKBP1ADRD3GAA
SCHEMBL8112327 0.82 L3MBTL1 (0.37) L3MBTL1FKBP1APOLBCYP1A1DRD3
SCHEMBL7299264 0.82 DRD3 (0.33) F2ELANECTSGCTRCPER2
SCHEMBL22604425 0.82 PER2 (0.36) L3MBTL1F2ELANECTSGCTRC

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101643-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20100233122-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2010-09-16 US disclosed
US-20090042762-A1 CLEANER COMPOSITION FOR REMOVAL OF LEAD-FREE SOLDERING FLUX, RINSING AGENT FOR REMOVAL OF LEAD-FREE SOLDERING FLUX, AND METHOD FOR REMOVAL OF LEAD-FREE SOLDERING FLUX ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 2009-02-12 US disclosed
EP-1295935-B1 DETERGENT COMPOSITION ARAKAWA CHEM IND (JP) 2007-03-21 EP disclosed
US-7018964-B2 The cleaning composition of this invention comprises, as effective components, a compound (A) represented by the formula (1) and a nonionic surfactant (B): polyoxyethylene glycol phosphate ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 2006-03-28 US disclosed
WO-2005014540-A1 CYCLIC AMINE BASE-1 INHIBITORS HAVING A HETEROCYCLIC SUBSTITUENT SCHERING CORPORATION (US) 2005-02-17 WO disclosed
US-20030181349-A1 The cleaning composition of this invention comprises, as effective components, a compound (A) represented by the formula (1) and a nonionic surfactant (B): polyoxyethylene glycol phosphate ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-25 US disclosed
EP-1295935-A1 DETERGENT COMPOSITION Arakawa Chemical Industries, Ltd. (JP) 2003-03-26 EP disclosed
EP-0718291-B1 Method for the preparation of triazole compounds CHUGAI PHARMACEUTICAL CO LTD (JP) 1998-07-08 EP disclosed
US-5567825-A Method for the preparation of a triazole compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1996-10-22 US disclosed
EP-0718291-A1 Method for the preparation of triazole compounds CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1996-06-26 EP 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-20100233122-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 L3MBTL1 1834/4885FKBP1A 1270/4885F2 4064/4885

“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.