SCHEMBL23456342

SCHEMBL23456342

COC(=O)c1cc(F)cc(O[C@@H]2CCN(C(=O)O)C2)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.40
CYP1A2 P05177 2/20 0.40
PIK3CD O00329 4/20 0.39
PIK3CA P42336 3/20 0.39
PIK3CB P42338 3/20 0.39
PIK3CG P48736 3/20 0.39
OPRM1 P35372 1/20 0.39
OPRK1 P41145 1/20 0.39
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 1/20 0.39
CHRM3 P20309 1/20 0.39
BCL9 O00512 4/20 0.37
CTNNB1 P35222 4/20 0.37
ADORA2A P29274 2/20 0.36

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
SCHEMBL23456316 1.00 EPHX2 (0.40) EPHX2CYP1A2PIK3CDPIK3CAPIK3CB
SCHEMBL23456315 1.00 EPHX2 (0.40) EPHX2CYP1A2PIK3CDPIK3CAPIK3CB
SCHEMBL22265669 0.86 PIK3CD (0.45) EPHX2CYP1A2PIK3CDPIK3CAPIK3CB
SCHEMBL22265757 0.86 PIK3CD (0.45) EPHX2CYP1A2PIK3CDPIK3CAPIK3CB
SCHEMBL28694105 0.86 PIK3CD (0.45) EPHX2CYP1A2PIK3CDPIK3CAPIK3CB
SCHEMBL30392239 0.85 GPR119 (0.46) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30391125 0.85 GPR119 (0.46) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20658806 0.82 EPHX2 (0.47) EPHX2OPRK1KMT2A
SCHEMBL20165095 0.81 KMT2A (0.46) EPHX2KMT2A
SCHEMBL20165094 0.81 KMT2A (0.46) EPHX2KMT2A

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-11542254-B2 Methods and composition of 4-substituted benzoylpiperazine-1-substituted carbonyls as beta-catenin/B-cell lymphoma 9 inhibitors UNIVERSISITY OF UTAH RESEARCH FOUNDATION (US) 2023-01-03 US disclosed
US-20210171502-A1 METHODS AND COMPOSITION OF 4-SUBSTITUTED BENZOYLPIPERAZINE-1-SUBSTITUTED CARBONYLS AS BETA-CATENIN/B-CELL LYMPHOMA 9 INHIBITORS UNITED STATES GOVERNMENT 2021-06-10 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-20210171502-A1 METHODS AND COMPOSITION OF 4-SUBSTITUTED BENZOYLPIPERAZINE-1-SUBSTITUTED CARBONYLS AS BETA-CATENIN/B-CELL LYMPHOMA 9 INHIBITORS BCL9, BCL9L, BCL3 EPHX2 3499/4885CYP1A2 2886/4885PIK3CD 990/4885
US-11542254-B2 Methods and composition of 4-substituted benzoylpiperazine-1-substituted carbonyls as beta-catenin/B-cell lymphoma 9 inhibitors BCL9, BCL9L, BCL3 EPHX2 3528/4885CYP1A2 2466/4885PIK3CD 1035/4885

“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.