SCHEMBL13035784

SCHEMBL13035784

CC(=O)COCCOCCNC(=O)COCCOCCN

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CES2 O00748 1/20 0.37
▸ CA2 P00918 5/20 0.36
▸ NCF1 P14598 1/20 0.34
▸ CA12 O43570 4/20 0.34
▸ CA1 P00915 4/20 0.34
▸ CA4 P22748 4/20 0.34
▸ CA9 Q16790 4/20 0.34
▸ CA14 Q9ULX7 4/20 0.34
▸ GLP1R P43220 5/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ SLC9A3 P48764 1/20 0.32
▸ ADRB2 P07550 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ TLR2 O60603 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ ENO1 P06733 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
SCHEMBL12655854 1.00 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL16426613 1.00 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL12850137 1.00 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL12666252 0.97 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL12666247 0.97 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL12666251 0.97 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL13649533 0.97 MEN1 (0.40) MEN1KMT2ACES2CA2NCF1
SCHEMBL24040332 0.91 MEN1 (0.41) MEN1KMT2ACA2NCF1CA12
SCHEMBL17029409 0.90 CA2 (0.38) MEN1KMT2ACES2CA2CA12
SCHEMBL26376485 0.89 CES2 (0.44) MEN1KMT2ACES2GLP1RSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11186608-B2 Solid phase synthesis of acylated peptides BACHEM HOLDING AG (CH) 2021-11-30 — — US disclosed
EP-2932981-B1 Albumin-binding derivatives of GLP-1 NOVO NORDISK AS (DK) 2021-06-16 — — EP disclosed
US-20210009631-A1 SOLID PHASE SYNTHESIS OF ACYLATED PEPTIDES BACHEM HOLDING AG (CH) 2021-01-14 — — US disclosed
EP-3110840-B1 AN A22K, DESB27, B29R, DES B30, AT EPSILON POSITION OF LYSINE 22 ACYLATED HUMAN INSULIN ANALOGUE NOVO NORDISK AS (DK) 2020-10-21 — — EP disclosed
WO-2017127827-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATION TUFTS MEDICAL CENTER (US) 2017-07-27 — — WO disclosed
US-9708383-B2 Double-acylated GLP-1 derivatives NOVO NORDISK A/S (DK) 2017-07-18 — — US disclosed
EP-2190873-B1 TRUNCATED GLP-1 DERIVATIVES AND THEIR THERAPEUTICAL USE NOVO NORDISK AS (DK) 2015-07-22 — — EP disclosed
EP-2178912-B1 INSULIN ANALOGUES WITH AN ACYL AND AKLYLENE GLYCOL MOIETY NOVO NORDISK AS (DK) 2015-07-08 — — EP disclosed
US-20140371148-A1 PEPTIDE-PEPTIDASE INHIBITOR CONJUGATES AND METHODS OF USING SAME ASTRAZENECA PHARMACEUTICALS LP 2014-12-18 — — US disclosed
EP-2190460-B1 PEPTIDES DERIVATIZED WITH A-B-C-D- AND THEIR THERAPEUTICAL USE NOVO NORDISK AS (DK) 2014-12-17 — — EP disclosed
US-8759295-B2 Peptide-peptidase inhibitor conjugates and methods of using same AMYLIN PHARMACEUTICALS, LLC (US) 2014-06-24 — — US disclosed
US-20130244931-A1 Novel GLP-1 Derivatives NOVO NORDISK AS (DK) 2013-09-19 — — US disclosed
US-8263739-B2 also targeting tumor cells that express vascular endothelial growth factor neuropilin-1 receptor; radiotherapy; radiopharmaceuticals; treating angiogenesis BRACCO SUISSE SA (CH) 2012-09-11 — — US disclosed
US-20100292172-A1 Peptide-Peptidase Inhibitor Conjugates and Methods of Using Same AMYLIN PHARMACEUTICALS, INC. (US) 2010-11-18 — — US disclosed
WO-2009030774-A1 TRUNCATED GLP-1 DERIVATIVES AND THEIR THERAPEUTICAL USE NOVO NORDISK A/S (DK) 2009-03-12 — — 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 (5 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-20210009631-A1 SOLID PHASE SYNTHESIS OF ACYLATED PEPTIDES QPCT, DNPEP, PTMS MEN1 1488/4885KMT2A 2448/4885CES2 3462/4885
US-20100292172-A1 Peptide-Peptidase Inhibitor Conjugates and Methods of Using Same DNPEP, PEPD, VIP MEN1 998/4885KMT2A 2386/4885CES2 253/4885
US-11186608-B2 Solid phase synthesis of acylated peptides QPCT, DNPEP, PTMS MEN1 1488/4885KMT2A 2448/4885CES2 3462/4885
US-20140371148-A1 PEPTIDE-PEPTIDASE INHIBITOR CONJUGATES AND METHODS OF USING SAME DNPEP, PEPD, VIP MEN1 998/4885KMT2A 2386/4885CES2 253/4885
US-20130244931-A1 Novel GLP-1 Derivatives GLP1R, GIPR, IAPP MEN1 680/4885KMT2A 4238/4885CES2 4581/4885

“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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