SCHEMBL25557607

SCHEMBL25557607

CC(C)(SC1CCCC1)C(NC(=O)c1ccc2ccccc2c1OCc1ccc(S(C)(=O)=O)cc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 4/20 0.41
▸ LMNA P02545 1/20 0.34
▸ GPR119 Q8TDV5 4/20 0.34
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ADRB1 P08588 2/20 0.33
▸ ADRB3 P13945 2/20 0.33
▸ SGMS2 Q8NHU3 1/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ CYP2D6 P10635 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ DRD3 P35462 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
SCHEMBL25548975 1.00 CXCR2 (0.41) CXCR2LMNAGPR119ALOX5APFEN1
SCHEMBL23461458 0.89 CNR2 (0.35) CXCR2GPR119ALOX5APFEN1CCR5
SCHEMBL23461459 0.89 CNR2 (0.35) CXCR2GPR119ALOX5APFEN1CCR5
SCHEMBL23460882 0.88 CXCR2 (0.55) CXCR2LMNA
SCHEMBL23460881 0.88 CXCR2 (0.55) CXCR2LMNA
SCHEMBL23461057 0.87 CXCR2 (0.44) CXCR2LMNAALDH1A1MEN1KMT2A
SCHEMBL23461056 0.87 CXCR2 (0.44) CXCR2LMNAALDH1A1MEN1KMT2A
SCHEMBL23460747 0.87 CXCR2 (0.38) CXCR2LMNAGPR119ALDH1A1CYP1A2
SCHEMBL25557643 0.87 CXCR2 (0.38) CXCR2LMNAGPR119ALDH1A1CYP1A2
SCHEMBL25548980 0.87 CXCR2 (0.38) CXCR2LMNAGPR119ALDH1A1CYP1A2

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 1205/4885LMNA 3155/4885GPR119 1239/4885

“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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