SCHEMBL4521889

SCHEMBL4521889

O=C(NC(Cc1ccc(F)cc1)C(=O)O)c1ccc2ccccc2c1OCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
ELANE P08246 4/20 0.49
CXCR2 P25025 1/20 0.48
ITGB1 P05556 6/20 0.48
ITGB3 P05106 5/20 0.48
ITGAV P06756 5/20 0.48
ITGA5 P08648 5/20 0.48
GPR34 Q9UPC5 2/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ITGA4 P13612 1/20 0.43
ITGB7 P26010 1/20 0.43

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
SCHEMBL4521881 1.00 ALDH1A1 (0.51) ALDH1A1ELANECXCR2ITGB1ITGB3
SCHEMBL4534596 0.95 ELANE (0.53) ELANECXCR2ITGB1ITGB3ITGAV
SCHEMBL4534602 0.95 ELANE (0.53) ELANECXCR2ITGB1ITGB3ITGAV
SCHEMBL4522750 0.91 CXCR2 (0.57) ALDH1A1ELANECXCR2ITGB1ITGB3
SCHEMBL4522743 0.91 CXCR2 (0.57) ALDH1A1ELANECXCR2ITGB1ITGB3
SCHEMBL25549035 0.91 ELANE (0.48) ELANECXCR2ITGB1ITGB3ITGAV
SCHEMBL23461000 0.91 GPR34 (0.56) ALDH1A1ELANECXCR2GPR34
SCHEMBL23461004 0.91 GPR34 (0.56) ALDH1A1ELANECXCR2GPR34
SCHEMBL23461455 0.91 CXCR2 (0.51) ELANECXCR2ITGB1ITGB3ITGAV
SCHEMBL23461456 0.91 CXCR2 (0.51) ELANECXCR2ITGB1ITGB3ITGAV

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-8501981-B2 CXCR2 inhibitors SANOFI (FR) 2013-08-06 US disclosed
US-20090227625-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-09-10 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-20090227625-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 ALDH1A1 2011/4885ELANE 245/4885CXCR2 1/4885

“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.