SCHEMBL30192548

SCHEMBL30192548

Cc1nn(-c2ccc(NC(=O)OC(C)(C)C)cn2)cc1-c1ccc(B2OC(C)(C)C(C)(C)O2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
CXCR2 P25025 4/20 0.33
MAPKAPK2 P49137 2/20 0.32
RORC P51449 5/20 0.32
NAMPT P43490 1/20 0.32
AAK1 Q2M2I8 1/20 0.31
BRD4 O60885 1/20 0.31
AR P10275 1/20 0.31
EGLN2 Q96KS0 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
SCHEMBL24896779 1.00 PTGDR2 (0.34) PTGDR2CXCR2MAPKAPK2RORCNAMPT
SCHEMBL30362248 0.87 PTGDR2 (0.38) PTGDR2MAPKAPK2RORCNAMPTAAK1
SCHEMBL25251320 0.87 PTGDR2 (0.38) PTGDR2MAPKAPK2RORCNAMPTAAK1
SCHEMBL26453252 0.85 PTGDR2 (0.36) PTGDR2MAPKAPK2RORCNAMPTBRD4
SCHEMBL30192499 0.84 PTGDR2 (0.36) PTGDR2MAPKAPK2RORCNAMPTBRD4
SCHEMBL30919455 0.84 PTGDR2 (0.36) PTGDR2MAPKAPK2RORCNAMPTBRD4
SCHEMBL24896789 0.84 PTGDR2 (0.36) PTGDR2MAPKAPK2RORCNAMPTBRD4
SCHEMBL25350925 0.80 NAMPT (0.35) PTGDR2MAPKAPK2RORCNAMPTAAK1
SCHEMBL30362262 0.80 NAMPT (0.35) PTGDR2MAPKAPK2RORCNAMPTAAK1
SCHEMBL25254861 0.79 MAPKAPK2 (0.36) PTGDR2MAPKAPK2NAMPTAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12421211-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2025-09-23 US disclosed
US-20240368117-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-07 US disclosed
US-11858912-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-01-02 US disclosed
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2023-05-04 US disclosed
WO-2023285497-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-19 WO 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 (4 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-11858912-B2 Heterocyclic compounds F12, C1R, MRPL21 PTGDR2 1206/4885CXCR2 121/4885MAPKAPK2 4701/4885
US-12421211-B2 Heterocyclic compounds F12, C1R, MRPL21 PTGDR2 1206/4885CXCR2 121/4885MAPKAPK2 4701/4885
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS F12, PM20D2, XDH PTGDR2 1349/4885CXCR2 93/4885MAPKAPK2 4682/4885
US-20240368117-A1 HETEROCYCLIC COMPOUNDS F12, C1R, MRPL21 PTGDR2 1206/4885CXCR2 121/4885MAPKAPK2 4701/4885

“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.