SCHEMBL25348786

SCHEMBL25348786

COc1nn(-c2ccc(NC(=O)O)cn2)cc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.35
CXCR2 P25025 4/20 0.33
PDGFRB P09619 1/20 0.33
KDR P35968 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALPL P05186 1/20 0.33
CCNA2 P20248 2/20 0.33
CDK2 P24941 2/20 0.33
MTOR P42345 1/20 0.33
EGLN1 Q9GZT9 2/20 0.32
MAPT P10636 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 1/20 0.32
DGAT1 O75907 1/20 0.32
PABPC1 P11940 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL30362262 0.88 NAMPT (0.35) ALPLDGAT1
SCHEMBL25350925 0.88 NAMPT (0.35) ALPLDGAT1
SCHEMBL25350428 0.87 MAPT (0.35) UCHL1CXCR2PDGFRBKDRCCNA2
SCHEMBL25352595 0.84 UCHL1 (0.36) UCHL1CXCR2PDGFRBKDRCCNA2
SCHEMBL25427469 0.84 RAB9A (0.40) UCHL1KDRMEN1KMT2AMAPT
SCHEMBL25355674 0.83 CXCR2 (0.33) CXCR2PDGFRBKDRCCNA2CDK2
SCHEMBL25414626 0.78 KMT2A (0.37) MEN1KMT2AEGLN1MAPTCYP1A2
SCHEMBL25251320 0.77 PTGDR2 (0.38) MAPTKDM4E
SCHEMBL30362248 0.77 PTGDR2 (0.38) MAPTKDM4E
SCHEMBL25254861 0.75 MAPKAPK2 (0.36)

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-20230295123-A1 NOVEL IMIDAZOLE-PYRAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-09-21 US disclosed
US-20230234939-A1 IMIDAZOLE-PYRAZOLE DERIVATIVES AS ANTIBACTERIALS HOFFMANN-LA ROCHE INC. (US) 2023-07-27 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-20230295123-A1 NOVEL IMIDAZOLE-PYRAZOLE DERIVATIVES CYP3A7, NISCH, ARG1 UCHL1 4493/4885CXCR2 2685/4885PDGFRB 1489/4885
US-20230234939-A1 IMIDAZOLE-PYRAZOLE DERIVATIVES AS ANTIBACTERIALS CYP3A7, NISCH, ARG1 UCHL1 4402/4885CXCR2 3465/4885PDGFRB 1540/4885

“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.