SCHEMBL13706984

SCHEMBL13706984

C[C@@H](CCCCNC(=O)CC[C@H](NC(=O)CCC(=O)NCCCOCCCCOCCCNC(=O)CCCCCCC(=O)O)C(N)=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.50
▸ NOD1 Q9Y239 4/20 0.41
▸ ESR1 P03372 1/20 0.40
▸ PGR P06401 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ AR P10275 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ TBXA2R P21731 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ TLR2 O60603 1/20 0.39
▸ SIRT5 Q9NXA8 1/20 0.39
▸ ALB P02768 1/20 0.38
▸ FOLH1 Q04609 2/20 0.37
▸ ROCK2 O75116 1/20 0.37

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
SCHEMBL13146898 0.93 GLP1R (0.57) GLP1RNOD1FOLH1
SCHEMBL13147082 0.93 GLP1R (0.57) GLP1RNOD1FOLH1
SCHEMBL13146974 0.93 GLP1R (0.57) GLP1RNOD1FOLH1
SCHEMBL13146896 0.93 GLP1R (0.57) GLP1RNOD1FOLH1
SCHEMBL13147020 0.93 GLP1R (0.57) GLP1RNOD1FOLH1
SCHEMBL13706963 0.92 GLP1R (0.47) GLP1RNOD1ESR1PGRHTR1A
SCHEMBL13706959 0.92 GLP1R (0.47) GLP1RNOD1ESR1PGRHTR1A
SCHEMBL13706956 0.92 GLP1R (0.47) GLP1RNOD1ESR1PGRHTR1A
SCHEMBL13146876 0.91 GLP1R (0.60) GLP1RNOD1FOLH1
SCHEMBL12521398 0.88 GLP1R (0.45) GLP1RNOD1TLR2SIRT5FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8933021-B2 Insulin derivative NOVO NORDISK A/S (DK) 2015-01-13 — — US disclosed
US-20090239785-A1 Insulin Derivative NOVO NORDISK A/S (DK) 2009-09-24 — — 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 (1 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-20090239785-A1 Insulin Derivative IAPP, INSR, GPR119 GLP1R 19/4885NOD1 1976/4885ESR1 1927/4885

“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.

Send feedback