SCHEMBL25549221

SCHEMBL25549221

CCC(C)(C)[C@H](NC(=O)c1ccc2cc(C)ccc2c1OCc1ccc(SC(F)(F)F)cc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 2/20 0.41
▸ PDE2A O00408 10/20 0.35
▸ PTPRZ1 P23471 2/20 0.34
▸ PTPN2 P17706 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ PTPN7 P35236 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33
▸ KCNK2 O95069 2/20 0.33
▸ KCNK10 P57789 1/20 0.33
▸ RXRA P19793 1/20 0.32
▸ HNF4A P41235 1/20 0.32

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
SCHEMBL25549232 0.93 CXCR2 (0.41) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23461209 0.92 CXCR2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL38664071 0.92 CXCR2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23461207 0.92 CXCR2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23461211 0.90 KCNK2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL38663507 0.90 KCNK2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23461214 0.90 KCNK2 (0.42) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23461567 0.89 CXCR2 (0.53) CXCR2PDE2APTPRZ1PTPN2PTPN1
SCHEMBL23460771 0.89 CXCR2 (0.53) CXCR2PTPN2PTPN1
SCHEMBL23460774 0.89 CXCR2 (0.53) CXCR2PTPN2PTPN1

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 1205/4885PDE2A 356/4885PTPRZ1 1172/4885

“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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