SCHEMBL12807256

SCHEMBL12807256

CCCOCCOCC(=O)NCCOCCOCC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.46
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ EPHX2 P34913 1/20 0.40
▸ FAAH O00519 1/20 0.40
▸ GLP1R P43220 8/20 0.38
▸ TSHR P16473 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NCF1 P14598 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL13226771 1.00 CES2 (0.46) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL15259279 1.00 CES2 (0.46) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL13154532 0.97 CES2 (0.42) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL16350546 0.95 CES2 (0.50) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL253658 0.95 CES2 (0.43) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL26376485 0.91 CES2 (0.44) CES2MEN1KMT2AFAAHGLP1R
SCHEMBL13034773 0.90 CES2 (0.43) CES2MEN1KMT2AFAAHGLP1R
SCHEMBL17697227 0.90 CES2 (0.49) CES2EPHX2FAAHGLP1RTSHR
SCHEMBL72044 0.90 CES2 (0.42) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL13113388 0.90 CES2 (0.42) CES2MEN1KMT2AEPHX2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3985002-A1 ARYL, HETEROARY, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS Achillion Pharmaceuticals, Inc. (US) 2022-04-20 — — EP disclosed
US-20170354713-A1 FGF21 Derivatives and Uses Thereof NOVO NORDISK AS (DK) 2017-12-14 — — US disclosed
US-9732137-B2 Semi-recombinant preparation of GLP-1 analogues NOVO NORDISK A/S (DK) 2017-08-15 — — US disclosed
US-9708383-B2 Double-acylated GLP-1 derivatives NOVO NORDISK A/S (DK) 2017-07-18 — — US disclosed
US-9409966-B2 Glucagon-like peptide-1 derivatives and their pharmaceutical use NOVO NORDISK A/S (DK) 2016-08-09 — — US disclosed
US-9067977-B2 Peptides derivatized with A-B-C-D- and their therapeutical use NOVO NORDISK A/S (DK) 2015-06-30 — — US disclosed
US-9056138-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO SUISSE SA (CH) 2015-06-16 — — US disclosed
US-20150025003-A1 GLUCAGON-LIKE PEPTIDE-1 DERIVATIVES AND THEIR PHARMACEUTICAL USE NOVO NORDISK AS (DK) 2015-01-22 — — US disclosed
US-8895694-B2 Glucagon-Like Peptide-1 derivatives and their pharmaceutical use NOVO NORDISK A/S (DK) 2014-11-25 — — US disclosed
US-20140205545-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS DYAX CORP. (US) 2014-07-24 — — US disclosed
US-20110286929-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS BRACCO INTERNATIONAL B.V. (NL) 2011-11-24 — — US disclosed
US-20110082079-A1 GLUCAGON-LIKE PEPTIDE-1 DERIVATIVES AND THEIR PHARMACEUTICAL USE NOVO NORDISK A/S (DK) 2011-04-07 — — US disclosed
US-7910088-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO SUISSE SA (CH) 2011-03-22 — — US disclosed
US-7854919-B2 Multivalent constructs for therapeutic and diagnostic applications Bracco, Suisse SA (CH) 2010-12-21 — — US disclosed
US-7666979-B2 polyvalent targeting ligands that bind to cells used for diagnosis of diseases sensitivity to angiogenesis factor BRACCO INTERNATIONAL B.V. (NL) 2010-02-23 — — US disclosed
US-20070243139-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS BRACCO INTERNATIONAL B.V. (NL) 2007-10-18 — — US disclosed
US-7261876-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO INTERNATIONAL BV (NL) 2007-08-28 — — US disclosed
US-20070172428-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS BRACCO INTERNATIONAL B.V. (NL) 2007-07-26 — — US disclosed
US-7211240-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO INTERNATIONAL B.V. (NL) 2007-05-01 — — US disclosed
US-20040210041-A1 Multimeric proteins for use in the treatment and detection of cell proliferative disorders ARBOGAST CHRISTOPHE (FR) 2004-10-21 — — 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 (8 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-20150025003-A1 GLUCAGON-LIKE PEPTIDE-1 DERIVATIVES AND THEIR PHARMACEUTICAL USE GLP1R, GIPR, GCGR CES2 4358/4885MEN1 2368/4885KMT2A 3521/4885
US-20140205545-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 CES2 2949/4885MEN1 202/4885KMT2A 2522/4885
US-20070243139-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 CES2 2949/4885MEN1 202/4885KMT2A 2522/4885
US-20110082079-A1 GLUCAGON-LIKE PEPTIDE-1 DERIVATIVES AND THEIR PHARMACEUTICAL USE GLP1R, GIPR, GCGR CES2 4358/4885MEN1 2368/4885KMT2A 3521/4885
US-20110286929-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 CES2 2949/4885MEN1 202/4885KMT2A 2522/4885
US-20170354713-A1 FGF21 Derivatives and Uses Thereof FGF2, FGFR1, FGF1 CES2 2735/4885MEN1 2805/4885KMT2A 4633/4885
US-20070172428-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 CES2 2949/4885MEN1 202/4885KMT2A 2522/4885
US-20040210041-A1 Multimeric proteins for use in the treatment and detection of cell proliferative disorders MKI67, TP53, VHL CES2 4733/4885MEN1 1320/4885KMT2A 3846/4885

“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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