SCHEMBL7006602

SCHEMBL7006602

CNCCOCCOCCOCCNC(=O)COCC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CES2 O00748 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ FAAH O00519 1/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NCF1 P14598 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ CA2 P00918 3/20 0.32
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA4 P22748 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ CA14 Q9ULX7 2/20 0.32
▸ GLP1R P43220 5/20 0.32
▸ SLC9A3 P48764 1/20 0.31
▸ HPGD P15428 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL13034764 1.00 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL13040233 1.00 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL19544555 0.97 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL21440855 0.97 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL21440826 0.97 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL12118184 0.97 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL12641023 0.97 MEN1 (0.41) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL15942666 0.93 CES2 (0.40) MEN1KMT2ACES2FAAHTSHR
SCHEMBL21242896 0.92 CES2 (0.42) MEN1KMT2ACES2SMN1; SMN2FAAH
SCHEMBL21242622 0.92 CES2 (0.42) MEN1KMT2ACES2SMN1; SMN2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2795317-B1 Composition for use in a method for cancer selection GE HEALTHCARE LTD (GB) 2018-05-30 — — EP disclosed
EP-2467365-B1 RADIOIODINATION METHOD GE HEALTHCARE LTD (GB) 2017-08-09 — — EP disclosed
EP-1768708-B1 N4 CHELATOR CONJUGATES GE HEALTHCARE LTD (GB) 2017-05-17 — — EP disclosed
EP-2509638-B1 IODINE RADIOLABELLING METHOD GE HEALTHCARE LTD (GB) 2017-04-19 — — EP disclosed
US-20160082136-A1 METAL COMPLEXES AND FLUORINATION THEREOF UNIVERSITY OF SOUTHAMPTON (GB) 2016-03-24 — — US disclosed
US-9259496-B2 Technetium labelled peptides GE HEALTHCARE LIMITED (GB) 2016-02-16 — — US disclosed
US-20160022846-A1 IODINE RADIOLABELLING METHOD GE HEALTHCARE LTD (GB) 2016-01-28 — — US disclosed
US-9180213-B2 Radiotracer compositions GE HEALTHCARE LIMITED (GB) 2015-11-10 — — US disclosed
US-20150126708-A1 RADIOFLUORINATION METHOD IMPERIAL INNOVATIONS LIMITED (GB) 2015-05-07 — — US disclosed
US-8940274-B2 Radioiodination method GE HEALTHCARE LIMITED (GB) 2015-01-27 — — US disclosed
US-20090203584-A1 Peptide-based Compounds GE HEALTHCARE LIMITED (GB) 2009-08-13 — — US disclosed
US-7521419-B2 Peptide-based compounds GE HEALTHCARE AS (NO) 2009-04-21 — — US disclosed
US-20080279769-A1 Enzyme Inhibitor Imaging Agents SOLBAKKEN MAGNE 2008-11-13 — — US disclosed
US-20080267881-A1 IMAGING AGENTS GE HEALTHCARE AS (NO) 2008-10-30 — — US disclosed
US-20080219921-A1 Novel Technetium and Rhenium Complexes. GE HEALTHCARE LIMITED (GB) 2008-09-11 — — US disclosed
US-7410943-B2 Imaging agents GE HEALTHCARE AS (NO) 2008-08-12 — — US disclosed
US-20080131368-A1 N4 Chelator Conjugates GE HEALTHCARE LIMITED (GB) 2008-06-05 — — US disclosed
US-20080095715-A1 Peptide Based-Compounds GE HEALTHCARE AS (NO) 2008-04-24 — — US disclosed
US-20070297979-A1 Pharmaceutical Compounds GE HEALTHCARE AS (NO) 2007-12-27 — — US disclosed
US-20070134155-A1 Pharmaceutical compounds AMERSHAM HEALTH AS (NO) 2007-06-14 — — 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 (11 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-20080219921-A1 Novel Technetium and Rhenium Complexes. IPO5, RAB35, TCOF1 MEN1 10/4885KMT2A 4055/4885CES2 3605/4885
US-20090203584-A1 Peptide-based Compounds ITGB3, ITGAV, SELPLG MEN1 769/4885KMT2A 4471/4885CES2 4605/4885
US-20070297979-A1 Pharmaceutical Compounds FURIN, ACE, PEPD MEN1 225/4885KMT2A 1851/4885CES2 860/4885
US-20080267881-A1 IMAGING AGENTS FLT1, FLT4, KDR MEN1 2726/4885KMT2A 3554/4885CES2 3704/4885
US-20160022846-A1 IODINE RADIOLABELLING METHOD BTD, BTN3A1, BTF3 MEN1 418/4885KMT2A 4017/4885CES2 1735/4885
US-20080279769-A1 Enzyme Inhibitor Imaging Agents MMP3, MMP1, MMP10 MEN1 547/4885KMT2A 1649/4885CES2 499/4885
US-20150126708-A1 RADIOFLUORINATION METHOD BTD, RABGGTB, PFAS MEN1 1306/4885KMT2A 1510/4885CES2 775/4885
US-20080095715-A1 Peptide Based-Compounds TEK, FLT4, FLT1 MEN1 649/4885KMT2A 4418/4885CES2 4463/4885
US-20070134155-A1 Pharmaceutical compounds NPPA, TNNT2, PCSK9 MEN1 543/4885KMT2A 3631/4885CES2 1042/4885
US-20160082136-A1 METAL COMPLEXES AND FLUORINATION THEREOF FOS, FGB, FOSB MEN1 13/4885KMT2A 1784/4885CES2 3455/4885
US-20080131368-A1 N4 Chelator Conjugates TTK, PIGK, HUNK MEN1 44/4885KMT2A 1001/4885CES2 1094/4885

“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.

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