SCHEMBL15711575

SCHEMBL15711575

CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCNC(=O)COCCOCCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)NC(=O)[C@H](CCCCNC(=O)COCCOCCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)NC(=O)COCCOCCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)C(=O)NCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ ESR1 P03372 1/20 0.50
▸ PGR P06401 1/20 0.50
▸ HTR1A P08908 1/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ AR P10275 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ TBXA2R P21731 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ ADRA1A P35348 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ EPHX2 P34913 1/20 0.45
▸ SELL P14151 3/20 0.41
▸ SELP P16109 3/20 0.41
▸ SELE P16581 3/20 0.41
▸ LGALS3 P17931 1/20 0.41
▸ ANPEP P15144 2/20 0.40

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
SCHEMBL15702040 1.00 GLP1R (0.53) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24239566 1.00 GLP1R (0.53) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL17519200 1.00 GLP1R (0.53) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24239564 1.00 GLP1R (0.53) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24453710 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24155697 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24696426 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL17519197 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24239603 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A
SCHEMBL24239602 0.97 MAPK1 (0.56) GLP1RMAPK1ESR1PGRHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3147367-A1 SMALL MOLECULE CONJUGATES FOR INTRACELLULAR DELIVERY OF NUCLEIC ACIDS F. Hoffmann-La Roche AG (CH) 2017-03-29 — — EP disclosed
US-20140135381-A1 Small molecule conjugates for intracellular delivery of biologically active compounds HOFFMANN-LA ROCHE INC. (US) 2014-05-15 — — US disclosed
US-20140135381-A1 Small molecule conjugates for intracellular delivery of biologically active compounds HOFFMANN-LA ROCHE INC. (US) 2014-05-15 — — 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-20140135381-A1 Small molecule conjugates for intracellular delivery of biologically active compounds SNRPE, PHAX, SNRPA GLP1R 4697/4885MAPK1 3839/4885ESR1 4095/4885

“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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