SCHEMBL25560463

SCHEMBL25560463

CCC[C@@](C)(CC)[C@H](NC(=O)c1ccc2ccc(Cl)cc2c1OCc1ccc(OC(F)(F)F)cc1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.39
DHODH Q02127 1/20 0.36
GCGR P47871 2/20 0.35
PTPN1 P18031 1/20 0.35
CYP3A4 P08684 1/20 0.35
SLC6A4 P31645 1/20 0.35
PPARG P37231 2/20 0.34
ALOX5 P09917 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.34
ITGB3 P05106 2/20 0.34
ITGA2B P08514 2/20 0.34
PPARA Q07869 2/20 0.34
PPARD Q03181 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
EPHX2 P34913 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL23460959 1.00 CXCR2 (0.39) CXCR2DHODHGCGRPTPN1CYP3A4
SCHEMBL23460963 1.00 CXCR2 (0.39) CXCR2DHODHGCGRPTPN1CYP3A4
SCHEMBL38147040 1.00 CXCR2 (0.39) CXCR2DHODHGCGRPTPN1CYP3A4
SCHEMBL23460873 0.91 CXCR2 (0.40) CXCR2GCGRPPARGALOX5TRPV1
SCHEMBL23460871 0.91 CXCR2 (0.40) CXCR2GCGRPPARGALOX5TRPV1
SCHEMBL23461001 0.91 CXCR2 (0.42) CXCR2DHODHGCGRPTPN1CYP3A4
SCHEMBL23461003 0.91 CXCR2 (0.42) CXCR2DHODHGCGRPTPN1CYP3A4
SCHEMBL23461526 0.91 CXCR2 (0.49) CXCR2PTPN1PPARGPPARAPPARD
SCHEMBL23461523 0.91 CXCR2 (0.49) CXCR2PTPN1PPARGPPARAPPARD
SCHEMBL38147042 0.91 CXCR2 (0.49) CXCR2PTPN1PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159438-A1 ARYLAMIDES AND METHODS OF USE THEREOF GENZYME CORPORATION 2023-05-25 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 (1 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-20230159438-A1 ARYLAMIDES AND METHODS OF USE THEREOF CFTR, AADAC, ARSA CXCR2 1205/4885DHODH 1523/4885GCGR 1145/4885

“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.