SCHEMBL4603386

SCHEMBL4603386

CCC(C)C(NC(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.53
CA1 P00915 4/20 0.53
CXCR2 P25025 7/20 0.53
CXCR1 P25024 1/20 0.53
CX3CR1 P49238 1/20 0.53
FPR2 P25090 3/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
MAPK1 P28482 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL4603389 1.00 CA2 (0.53) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL4603663 0.89 POLB (0.53) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL4603360 0.85 CXCR2 (0.58) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL4604026 0.84 CXCR2 (0.59) CXCR2CXCR1CX3CR1
SCHEMBL4604802 0.82 CXCR2 (0.63) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL4604688 0.81 CXCR2 (0.56) CA2CA1CXCR2CXCR1CX3CR1
Isoleucine SCHEMBL27573325 0.80 CXCR2 (0.50) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL4607210 0.78 CXCR2 (0.63) CXCR2CXCR1CX3CR1
SCHEMBL4605221 0.76 CXCR2 (0.60) CA2CA1CXCR2CXCR1CX3CR1
SCHEMBL6444067 0.75 CXCR2 (0.54) CA2CA1CXCR2CXCR1CX3CR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265603-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2008-07-16 EP claimed
EP-1265603-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-28 EP claimed
US-6767922-B2 ADMINISTERING N-(3-AMINOSULFONYL-2-HYDROXYPHENYL)-UREA DERIVATIVES; TREATMENT OF RESPIRATORY AND NERVOUS SYSTEM DISORDERS; ARTHRITIS, ASTHMA; VIRICIDES SMITHKLINE BEECHAM CORPORATION 2004-07-27 US claimed
US-20030065188-A1 Il-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-04-03 US claimed
EP-1265603-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-18 EP claimed
WO-2001068570-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-20 WO claimed
EP-1265603-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2008-07-16 EP disclosed
EP-1265603-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-28 EP disclosed
US-6767922-B2 ADMINISTERING N-(3-AMINOSULFONYL-2-HYDROXYPHENYL)-UREA DERIVATIVES; TREATMENT OF RESPIRATORY AND NERVOUS SYSTEM DISORDERS; ARTHRITIS, ASTHMA; VIRICIDES SMITHKLINE BEECHAM CORPORATION 2004-07-27 US disclosed
US-20030065188-A1 Il-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-04-03 US disclosed
EP-1265603-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-18 EP disclosed
WO-2001068570-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-20 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-20030065188-A1 Il-8 receptor antagonists CXCL8, CCR8, IL1RN CA2 3402/4885CA1 3382/4885CXCR2 9/4885

“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.