SCHEMBL13226771

SCHEMBL13226771

CCCOCC(=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
SCHEMBL15259279 1.00 CES2 (0.46) CES2MEN1KMT2AEPHX2FAAH
SCHEMBL12807256 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024073622-A2 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING EPHRIN TYPE-A RECEPTOR 2 AND USES THEREOF RAYZEBIO, INC. (US) 2024-04-04 — — WO disclosed
US-9480753-B2 FGF21 derivatives with albumin binder A-B-C-D-E- and their use NOVO NORDISK A/S (DK) 2016-11-01 — — 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-9067977-B2 Peptides derivatized with A-B-C-D- and their therapeutical use NOVO NORDISK A/S (DK) 2015-06-30 — — US disclosed
US-20140011732-A1 Peptides Derivatized with A-B-C-D- and their Therapeutical Use NOVO NORDISK A/S (DK) 2014-01-09 — — US disclosed
US-20140011732-A1 Peptides Derivatized with A-B-C-D- and their Therapeutical Use NOVO NORDISK A/S (DK) 2014-01-09 — — US disclosed
US-8536122-B2 Acylated GLP-1 compounds NOVO NORDISK A/S (DK) 2013-09-17 — — US disclosed
US-20100216715-A1 FGF21 Derivatives With Albumin Binder A-B-C-D-E- And Their Use NOVO NORDISK A/S (DK) 2010-08-26 — — 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 (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-20140011732-A1 Peptides Derivatized with A-B-C-D- and their Therapeutical Use GLP1R, IAPP, GIPR CES2 3338/4885MEN1 2167/4885KMT2A 4267/4885
US-20100216715-A1 FGF21 Derivatives With Albumin Binder A-B-C-D-E- And Their Use FABP1, FABP4, FGFR1 CES2 1274/4885MEN1 4363/4885KMT2A 4434/4885

“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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