SCHEMBL12568253

SCHEMBL12568253

C[C@@](Cc1ccc(-c2ccccc2)cc1)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.46
▸ MDM4 O15151 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ ITGB3 P05106 1/20 0.43
▸ ITGA2B P08514 1/20 0.43
▸ MDM2 Q00987 3/20 0.42
▸ CASP3 P42574 2/20 0.41

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
SCHEMBL30802567 0.93 KMT2A (0.49) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL12297754 0.93 KMT2A (0.49) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL29855073 0.93 KMT2A (0.49) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL31195699 0.93 KMT2A (0.49) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL18237209 0.93 KMT2A (0.49) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL18614206 0.90 KMT2A (0.45) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL32683646 0.90 KMT2A (0.45) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL20338593 0.90 KMT2A (0.45) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL12297763 0.89 MDM2 (0.46) KMT2AMDM4TP53EPHX2ITGB3
SCHEMBL25362437 0.88 ITGB3 (0.45) KMT2AMDM4TP53EPHX2ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960349-B2 N-terminally modified GLP-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-06-14 — — US disclosed
US-20080242593-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2008-10-02 — — US disclosed
US-7417028-B2 Human glucagon-like-peptide-1 modulators and their use in treatment of diabetes and related conditions BRISTOL-MYERS SQUIBB COMPANY (US) 2008-08-26 — — US disclosed
US-20070021346-A1 N-terminally modified GLP-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2007-01-25 — — 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-20070021346-A1 N-terminally modified GLP-1 receptor modulators GLP1R, GIPR, IAPP KMT2A 2687/4885MDM4 4866/4885TP53 4145/4885
US-20080242593-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS GLP1R, GIPR, IAPP KMT2A 3518/4885MDM4 4725/4885TP53 4340/4885

“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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