SCHEMBL5595331

SCHEMBL5595331

COc1ccccc1NC(=O)Nc1cccc(-c2ccccc2)c1O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
RAB9A P51151 4/20 0.55
KMT2A Q03164 4/20 0.55
NPC1 O15118 3/20 0.55
MAPT P10636 6/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LPAR1 Q92633 1/20 0.54
ALDH1A1 P00352 3/20 0.54
ADORA3 P0DMS8 2/20 0.54
GAA P10253 2/20 0.54
HTT P42858 2/20 0.54
ADORA2A P29274 1/20 0.54
MAPK1 P28482 1/20 0.54
MEN1 O00255 3/20 0.52
HPGD P15428 2/20 0.52
KDM4E B2RXH2 1/20 0.52
HSD17B10 Q99714 1/20 0.52
NPSR1 Q6W5P4 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
SCHEMBL5595021 0.87 MEN1 (0.61) POLBRAB9AKMT2ANPC1MAPT
SCHEMBL12368164 0.84 KMT2A (0.64) POLBRAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL5595432 0.84 RET (0.56) KMT2AMAPTALDH1A1HTTMEN1
SCHEMBL7491718 0.83 SMN1; SMN2 (0.61) POLBRAB9AKMT2ANPC1MAPT
SCHEMBL31040567 0.82 POLB (0.77) POLBRAB9AKMT2ANPC1MAPT
SCHEMBL4554983 0.82 POLB (0.77) POLBRAB9AKMT2ANPC1MAPT
SCHEMBL5595859 0.78 CA12 (0.57) RAB9AKMT2ANPC1MAPTHTT
SCHEMBL16429258 0.77 MAOA (0.57) POLBRAB9ANPC1ALDH1A1GAA
SCHEMBL5664848 0.77 CA12 (0.65) POLBRAB9AKMT2ANPC1MAPT
SCHEMBL7487115 0.77 LMNA (0.55) POLBRAB9AKMT2ANPC1MAPT

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 13 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-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
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
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 POLB 4279/4885RAB9A 1746/4885KMT2A 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.