SCHEMBL33526555

SCHEMBL33526555

Cc1ccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cn1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.57
ITGA2B P08514 1/20 0.57
ACE P12821 1/20 0.55
ITGA4 P13612 2/20 0.53
ITGB7 P26010 2/20 0.53
PTPN1 P18031 3/20 0.52
PPARA Q07869 7/20 0.50
PPARG P37231 6/20 0.50
CTSS P25774 6/20 0.49
CTSK P43235 5/20 0.49
PPARD Q03181 2/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48

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
SCHEMBL12241482 1.00 ITGB3 (0.57) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL33526968 0.89 KLK5 (0.50) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL12241473 0.89 KLK5 (0.50) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL27041520 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL27041522 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL2072417 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL2072419 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL8025768 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL16644977 0.86 ITGB3 (0.56) ITGB3ITGA2BACEITGA4ITGB7
SCHEMBL31407738 0.85 ITGA4 (0.56) ITGB3ITGA2BACEITGA4ITGB7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260091048-A1 GIP RECEPTOR AGONIST COMPOUNDS LILLY CO ELI (US) 2026-04-02 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-20260091048-A1 GIP RECEPTOR AGONIST COMPOUNDS GIPR, GLP1R, GPR119 ITGB3 1087/4885ITGA2B 1892/4885ACE 4008/4885

“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.