SCHEMBL2589150

SCHEMBL2589150

NCCc1cccc2c1oc1c(CCC=O)cccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC11A2 P49281 1/20 0.43
TAAR1 Q96RJ0 9/20 0.36
ALOX5 P09917 1/20 0.35
HMGB1 P09429 1/20 0.35
MPO P05164 2/20 0.34
SLC6A4 P31645 1/20 0.34
HTR2A P28223 5/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2A6 P11509 1/20 0.33
NFKB1 P19838 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
CTSK P43235 1/20 0.33
HTR6 P50406 1/20 0.33
CYP2A13 Q16696 1/20 0.33
MAPT P10636 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
SCHEMBL30320123 0.76 PARP1 (0.46) SLC11A2TAAR1ALOX5HMGB1MAPT
SCHEMBL198085 0.76 PARP1 (0.46) SLC11A2TAAR1ALOX5HMGB1MAPT
SCHEMBL8374054 0.75 ALOX5 (0.55) SLC11A2TAAR1ALOX5MPOHTR2A
SCHEMBL198086 0.70 SLC11A2 (0.40) SLC11A2ALOX5HMGB1
SCHEMBL28843796 0.69 KMT2A (0.41) SLC11A2TAAR1ALOX5HMGB1HTR2A
SCHEMBL23900879 0.69 GLA (0.66) TAAR1HTR2AMAPTSMN1; SMN2NPSR1
SCHEMBL143458 0.68 MTNR1A (0.49) CYP1A2CYP2D6MAPT
SCHEMBL28607303 0.68 ADH1B (0.36) TAAR1MPOHTR2ACYP2D6CYP2A6
SCHEMBL6563339 0.68 TAAR1 (0.54) TAAR1HMGB1MPOSLC6A4HTR2A
SCHEMBL11611663 0.67 PNMT (0.41) TAAR1HTR2ACYP2A6SMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107129538-B Peptide conjugates of GLP-1 receptor agonists and gastrin and uses thereof 西兰制药公司 2021-07-16 CN disclosed
US-10406207-B2 Peptide conjugates of GLP-1 receptor agonists and gastrin and their use ZEALAND PHARMA A/S (DK) 2019-09-10 US disclosed
US-20170281709-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE ZEALAND PHARMA A/S (DK) 2017-10-05 US disclosed
US-9649362-B2 Peptide conjugates of GLP-1 receptor agonists and gastrin and their use ZEALAND PHARMA A/S (DK) 2017-05-16 US disclosed
EP-2563808-B1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE ZEALAND PHARMA AS (DK) 2016-12-07 EP disclosed
US-20160184400-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE ZEALAND PHARMA A/S (DK) 2016-06-30 US disclosed
US-9089538-B2 Peptide conjugates of GLP-1 receptor agonists and gastrin and their use ZEALAND PHARMA A/S (DK) 2015-07-28 US disclosed
US-20130143793-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE ZEALAND PHARMA A/S (DK) 2013-06-06 US disclosed
EP-2563808-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE Zealand Pharma A/S (DK) 2013-03-06 EP disclosed
WO-2011134471-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE ZEALAND PHARMA A/S (DK) 2011-11-03 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 (4 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-20170281709-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE GLP1R, GIPR, GRPR SLC11A2 1937/4885TAAR1 768/4885ALOX5 4472/4885
US-10406207-B2 Peptide conjugates of GLP-1 receptor agonists and gastrin and their use GLP1R, GIPR, GRPR SLC11A2 1937/4885TAAR1 768/4885ALOX5 4472/4885
US-20160184400-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE GLP1R, GIPR, GRPR SLC11A2 1946/4885TAAR1 761/4885ALOX5 4470/4885
US-20130143793-A1 PEPTIDE CONJUGATES OF GLP-1 RECEPTOR AGONISTS AND GASTRIN AND THEIR USE GLP1R, GIPR, GRPR SLC11A2 1946/4885TAAR1 761/4885ALOX5 4470/4885

“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.