SCHEMBL29774715

SCHEMBL29774715

CC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 3/20 0.50
▸ ITGB1 P05556 1/20 0.50
▸ ITGA4 P13612 1/20 0.50
▸ CPA1 P15085 1/20 0.44
▸ CPA2 P48052 1/20 0.44
▸ CPA4 Q9UI42 1/20 0.44
▸ VHL P40337 1/20 0.42
▸ XIAP P98170 1/20 0.42
▸ GRB2 P62993 1/20 0.41
▸ STAT3 P40763 2/20 0.41
▸ PLG P00747 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ ACE P12821 2/20 0.39
▸ REN P00797 2/20 0.39

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
SCHEMBL29617972 0.92 ITGB1 (0.45) F2ITGB1ITGA4CPA1CPA2
SCHEMBL29617974 0.92 ITGB1 (0.45) F2ITGB1ITGA4CPA1CPA2
SCHEMBL25634796 0.91 ITGB1 (0.49) F2ITGB1ITGA4CPA1CPA2
SCHEMBL28890641 0.88 F2 (0.42) F2ITGB1ITGA4XIAPGRB2
SCHEMBL17997394 0.88 F2 (0.42) F2ITGB1ITGA4XIAPGRB2
SCHEMBL29573758 0.86 GRB2 (0.56) XIAPGRB2STAT3OPRM1ACE
SCHEMBL17274603 0.84 KMT2A (0.39) F2ITGB1ITGA4GRB2STAT3
SCHEMBL29572637 0.84 DPP4 (0.47) XIAPGRB2STAT3KMT2AOPRM1
SCHEMBL30121019 0.84 ACE (0.49) F2ITGB1ITGA4CPA1CPA2
SCHEMBL30563305 0.83 GRB2 (0.44) F2GRB2ACE

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-11834482-B2 Agents modulating beta-catenin functions and methods thereof FOG PHARMACEUTICALS, INC. (US) 2023-12-05 — — US disclosed
US-20220213154-A1 AGENTS MODULATING BETA-CATENIN FUNCTIONS AND METHODS THEREOF PARABILIS MEDICINES, INC. 2022-07-07 — — 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-20220213154-A1 AGENTS MODULATING BETA-CATENIN FUNCTIONS AND METHODS THEREOF CTNNB1, CTNNBL1, CTNNA1 F2 3818/4885ITGB1 640/4885ITGA4 1923/4885
US-11834482-B2 Agents modulating beta-catenin functions and methods thereof CTNNB1, CTNNBL1, CTNNA1 F2 3818/4885ITGB1 640/4885ITGA4 1923/4885

“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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