SCHEMBL5595113

SCHEMBL5595113

COc1ccc(NC(=O)Nc2cc3ccccc3cc2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.64
NPC1 O15118 8/20 0.64
RAB9A P51151 8/20 0.64
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
CASP3 P42574 2/20 0.64
SENP7 Q9BQF6 2/20 0.64
SENP6 Q9GZR1 1/20 0.64
SMN1; SMN2 Q16637 8/20 0.63
MAPT P10636 5/20 0.63
PKM P14618 3/20 0.62
NFKB1 P19838 1/20 0.62
NFKB2 Q00653 1/20 0.62
RELA Q04206 1/20 0.62
TP53 P04637 3/20 0.58
TSHR P16473 1/20 0.58
IGF1R P08069 1/20 0.58
MAPK1 P28482 2/20 0.57
MECP2 P51608 1/20 0.57
GAA P10253 1/20 0.56

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
SCHEMBL7552432 0.83 MEN1 (0.64) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL5595819 0.82 MAPT (0.55) NPC1RAB9AMAPTKDM4E
SCHEMBL4237969 0.82 MAPT (0.67) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL5595153 0.81 RAB9A (0.58) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL8899001 0.81 TP53 (0.60) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL5595004 0.81 MEN1 (0.68) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL6763008 0.81 CXCR2 (0.67) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11106394 0.80 RAB9A (0.85) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL11092496 0.79 RAB9A (1.00) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL29644384 0.78 NPC1 (1.00) POLBNPC1RAB9AMEN1KMT2A

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 4279/4885NPC1 1517/4885RAB9A 1746/4885

“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.