SCHEMBL5595504

SCHEMBL5595504

Cc1cccc(C)c1NC(=O)Nc1ccc([N+](=O)[O-])cc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 3/20 0.66
CXCR2 P25025 3/20 0.66
KMT2A Q03164 7/20 0.63
MEN1 O00255 6/20 0.63
TDP1 Q9NUW8 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63
DDX3X O00571 1/20 0.56
KCNMA1 Q12791 1/20 0.55
MAPT P10636 8/20 0.55
LMNA P02545 3/20 0.55
HTT P42858 3/20 0.55
RORC P51449 1/20 0.55
TRPV1 Q8NER1 1/20 0.55
NPSR1 Q6W5P4 2/20 0.52
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPK1 P28482 2/20 0.52
HPGD P15428 1/20 0.51
HTR1E P28566 1/20 0.51
PAX8 Q06710 1/20 0.51

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
SCHEMBL5595057 0.93 CXCR1 (0.60) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL6823083 0.92 MAPT (0.60) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL5594962 0.88 MEN1 (0.72) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL5595104 0.86 CXCR1 (0.80) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL5594659 0.84 CXCR1 (0.66) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL6920109 0.84 CXCR1 (0.66) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL4341663 0.82 CXCR1 (0.59) CXCR1CXCR2KMT2ADDX3XMAPT
SCHEMBL6921794 0.81 KMT2A (0.51) CXCR1CXCR2KMT2AMEN1TDP1
SCHEMBL6566895 0.80 CXCR2 (0.66) CXCR1CXCR2KMT2AMEN1DDX3X
SCHEMBL6823468 0.80 RAB9A (0.68) CXCR1CXCR2KMT2AMEN1TDP1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0809492-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2007-01-24 EP disclosed
US-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 US disclosed
US-6262113-B1 HYDROXY- OR MERCAPTO-PHENYLUREAS SMITHKLINE BEECHAM CORPORATION 2001-07-17 US disclosed
US-6211373-B1 Phenyl urea antagonists of the IL-8 receptor SMITHKLINE BEECHAM CORPORATION 2001-04-03 US disclosed
US-6180675-B1 THERAPY FOR CHEMOKINE SENSITIVE DISEASE; USING A AROMATIC (THIO)UREA COMPOUND SMITHKLINE BEECHAM CORPORATION 2001-01-30 US disclosed
US-6005008-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-12-21 US disclosed
EP-0809492-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-03 EP disclosed
WO-1996025157-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-08-22 WO 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-20020128321-A1 IL-8 receptor antagonists CXCL8, CCR8, IL1RN CXCR1 21/4885CXCR2 15/4885KMT2A 3978/4885

“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.