SCHEMBL5595089

SCHEMBL5595089

NC(=O)C=Cc1cccc(N)c1O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.47
MMP2 P08253 1/20 0.44
PELI1 Q96FA3 2/20 0.41
NFKB1 P19838 2/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
JUN P05412 1/20 0.40
NFE2L2 Q16236 1/20 0.40
BACE1 P56817 2/20 0.40
PTPN1 P18031 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ALOX5 P09917 1/20 0.36
MCL1 Q07820 1/20 0.36
BCHE P06276 1/20 0.36
GUSB P08236 1/20 0.36

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
SCHEMBL11216321 0.85 CA1 (0.56) IAPPMMP2NFKB1CA1CA2
SCHEMBL11216324 0.85 CA1 (0.56) IAPPMMP2NFKB1CA1CA2
Hydrochloric Acid SCHEMBL11214212 0.84 CA1 (0.55) IAPPMMP2NFKB1CA1CA2
Hydrochloric Acid SCHEMBL11214216 0.84 CA1 (0.55) IAPPMMP2NFKB1CA1CA2
SCHEMBL5465666 0.83 IAPP (0.68) IAPPNFKB1JUNNFE2L2BACE1
SCHEMBL29913492 0.82 PTPN1 (0.45) PELI1NFKB1CCNCCDK8JUN
SCHEMBL15941356 0.82 PTPN1 (0.45) PELI1NFKB1CCNCCDK8JUN
SCHEMBL11214993 0.80 ALDH1A1 (0.50) IAPPNFE2L2BACE1PTPN1CA1
SCHEMBL11214996 0.80 ALDH1A1 (0.50) IAPPNFE2L2BACE1PTPN1CA1
SCHEMBL2328371 0.78 NFKB1 (0.50) PELI1NFKB1CCNCCDK8JUN

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 16 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
EP-1185261-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-02-25 EP disclosed
EP-0896531-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-10-30 EP disclosed
US-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 US disclosed
EP-1185261-A1 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-03-13 EP 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
WO-2000076495-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-12-21 WO disclosed
US-6005008-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-12-21 US disclosed
US-5886044-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-03-23 US disclosed
EP-0896531-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-17 EP disclosed
US-5780483-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1998-07-14 US disclosed
EP-0809492-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-03 EP disclosed
WO-1997029743-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-08-21 WO 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 IAPP 729/4885MMP2 2068/4885PELI1 792/4885

“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.