SCHEMBL25548880

SCHEMBL25548880

CC(C)(C)C[C@H](NC(=O)c1ccc2cc(F)ccc2c1OCc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 1/20 0.37
▸ ITGB3 P05106 4/20 0.36
▸ ITGB1 P05556 4/20 0.36
▸ ITGAV P06756 4/20 0.36
▸ ITGA5 P08648 4/20 0.36
▸ GRN P28799 2/20 0.36
▸ SORT1 Q99523 2/20 0.36
▸ KIFC1 Q9BW19 1/20 0.35
▸ GPR34 Q9UPC5 2/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ MME P08473 1/20 0.35
▸ ACE P12821 1/20 0.35
▸ CPA1 P15085 1/20 0.35
▸ ACE2 Q9BYF1 1/20 0.35
▸ CTSL P07711 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.34
▸ CASP3 P42574 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
SCHEMBL23461787 0.89 CXCR2 (0.49) CXCR2GRNSORT1KIFC1PTPN1
SCHEMBL38666243 0.89 CXCR2 (0.49) CXCR2GRNSORT1KIFC1PTPN1
SCHEMBL23461785 0.89 CXCR2 (0.49) CXCR2GRNSORT1KIFC1PTPN1
SCHEMBL25549059 0.89 CXCR2 (0.48) CXCR2GRNSORT1KIFC1PTPN1
SCHEMBL25548714 0.88 CXCR2 (0.38) CXCR2ITGB3ITGB1ITGAVITGA5
SCHEMBL25549762 0.88 CXCR2 (0.38) CXCR2ITGB3ITGB1ITGAVITGA5
SCHEMBL23460807 0.86 CXCR2 (0.43) CXCR2ITGB3ITGB1ITGAVITGA5
SCHEMBL23460805 0.86 CXCR2 (0.43) CXCR2ITGB3ITGB1ITGAVITGA5
SCHEMBL38147098 0.86 CXCR2 (0.43) CXCR2ITGB3ITGB1ITGAVITGA5
SCHEMBL38662642 0.86 GRN (0.40) CXCR2ITGB3ITGB1ITGAVITGA5

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-20230159438-A1 ARYLAMIDES AND METHODS OF USE THEREOF GENZYME CORPORATION 2023-05-25 — — US disclosed
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 1205/4885ITGB3 3195/4885ITGB1 4082/4885

“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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