SCHEMBL25548770

SCHEMBL25548770

CC1(C(NC(=O)c2ccc3ccccc3c2OCc2ccc(S(F)(F)(F)(F)F)cc2)C(=O)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 6/20 0.45
▸ PDE2A O00408 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ TACR2 P21452 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAOA P21397 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ TOP2A P11388 1/20 0.34
▸ TOP2B Q02880 1/20 0.34
▸ ELANE P08246 2/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ SLC6A5 Q9Y345 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
SCHEMBL25548766 0.96 CXCR2 (0.44) CXCR2PDE2AALDH1A1GAAMAPT
SCHEMBL25548792 0.92 CXCR2 (0.44) CXCR2ALDH1A1GAAMAPTTACR2
SCHEMBL23461082 0.88 CXCR2 (0.60) CXCR2ALDH1A1GAAMAPTKDM4E
SCHEMBL25548758 0.85 CNR2 (0.35) CXCR2PDE2ASLC6A5
SCHEMBL25601485 0.85 CXCR2 (0.42) CXCR2LMNA
SCHEMBL23460976 0.85 CXCR2 (0.49) CXCR2ALDH1A1GAAMAPTTACR2
SCHEMBL25548759 0.85 CXCR2 (0.49) CXCR2ALDH1A1GAAMAPTTACR2
SCHEMBL25598629 0.85 CXCR2 (0.42) CXCR2LMNA
SCHEMBL25548794 0.84 CXCR2 (0.45) CXCR2ALDH1A1GAAMAPTKDM4E
SCHEMBL25549217 0.84 CXCR2 (0.45) CXCR2ALDH1A1GAAMAPTKDM4E

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 1205/4885PDE2A 356/4885ALDH1A1 1072/4885

“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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