SCHEMBL600790

SCHEMBL600790

C1C[N]CCCNCCCNC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 1/20 0.44
HIF1A Q16665 1/20 0.33
MAPT P10636 1/20 0.33
PDE4A P27815 1/20 0.33
KDR P35968 1/20 0.33

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
SCHEMBL235202 0.96
SCHEMBL674050 0.91 CXCR4 (0.53) CXCR4SMN1; SMN2ALDH1A1HIF1AMAPT
SCHEMBL1782168 0.90 CXCR4 (0.41) CXCR4SMN1; SMN2ALDH1A1HIF1AMAPT
SCHEMBL1779850 0.90 CXCR4 (0.50) CXCR4SMN1; SMN2ALDH1A1HIF1AMAPT
SCHEMBL10036 0.90
SCHEMBL567977 0.87 ALDH1A1 (0.56) CXCR4SMN1; SMN2ALDH1A1
SCHEMBL674177 0.83 ALDH1A1 (0.60) CXCR4SMN1; SMN2ALDH1A1HIF1AMAPT
SCHEMBL175198 0.80
SCHEMBL566326 0.78 ALDH1A1 (0.53) CXCR4SMN1; SMN2ALDH1A1
SCHEMBL18687 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111533744-A Non-viral vector, preparation method and application thereof 德州学院 2020-08-14 CN claimed
EP-2991980-B1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-01-02 EP claimed
US-8722956-B2 Kit for decomposing organophosphorus compounds QUEEN'S UNIVERSITY AT KINGSTON (US) 2014-05-13 US claimed
EP-1613402-B1 METHOD OF DECOMPOSING ORGANOPHOSPHORUS COMPOUNDS UNIV KINGSTON (CA) 2013-01-16 EP claimed
US-20110253580-A1 Method of Decomposing Organophosphorus Compounds QUEEN'S UNIVERSITY AT KINGSTON (CA) 2011-10-20 US claimed
US-7875739-B2 Detoxification of hazardous materials; rapid lanthanum ion catalyzed alcoholysis QUEEN'S UNIVERSITY AT KINGSTON (CA) 2011-01-25 US claimed
US-20070299275-A1 Method of decomposing organophosphorus compounds BROWN R S 2007-12-27 US claimed
US-7214836-B2 Method of decomposing organophosphorus compounds QUEEN'S UNIVERSITY AT KINGSTON (CA) 2007-05-08 US claimed
US-20040230082-A1 Method of decomposing organophosphorus compounds QUEEN'S UNIVERSITY AT KINGSTON (CA) 2004-11-18 US claimed
EP-3367820-B1 PREPARATION OF MODIFIED CELLULOSE AND ITS DERIVATIVES INNOTECH MAT LLC (US) 2024-01-24 EP disclosed
CN-110582485-B Pyrazole derivatives as bromodomain inhibitors 葛兰素史克知识产权第二有限公司 2023-10-13 CN disclosed
EP-3589618-B1 PYRAZOLE DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2022-12-28 EP disclosed
CN-109153646-B Pyridine dicarboxamide derivatives as bromodomain inhibitors 葛兰素史克知识产权第二有限公司 2022-08-02 CN disclosed
EP-3692026-B1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS. GLAXOSMITHKLINE IP NO 2 LTD (GB) 2022-07-06 EP disclosed
EP-0937042-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1999-08-25 EP disclosed
US-5925759-A PRODUCING NELFINAVIR MESYLATE FROM TARTARIC ACID AGOURON PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
EP-0874830-A1 METALLOPROTEINASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR PHARMACEUTICAL USES, AND METHODS AND INTERMEDIATES USEFUL FOR THEIR PREPARATION AGOURON PHARMACEUTICALS, INC. (US) 1998-11-04 EP disclosed
WO-1998017643-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1998-04-30 WO disclosed
US-5705647-A BENZOIC ACID OXAZOLE DERIVATIVES FOR TREATMENT OF AIDS AGOURON PHARMACEUTICALS, INC. (US) 1998-01-06 US disclosed
WO-1997020824-A1 METALLOPROTEINASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR PHARMACEUTICAL USES, AND METHODS AND INTERMEDIATES USEFUL FOR THEIR PREPARATION AGOURON PHARMACEUTICALS, INC. (US) 1997-06-12 WO 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-20070299275-A1 Method of decomposing organophosphorus compounds ACHE, L3MBTL3, L3MBTL4 CXCR4 3927/4885SMN1; SMN2 138/4885ALDH1A1 618/4885
US-20040230082-A1 Method of decomposing organophosphorus compounds ACHE, L3MBTL3, L3MBTL4 CXCR4 3927/4885SMN1; SMN2 138/4885ALDH1A1 618/4885

“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.