SCHEMBL5227411

SCHEMBL5227411

Fc1cccc(F)c1-c1cccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
HPGD P15428 4/20 0.46
KDM4E B2RXH2 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LTA4H P09960 1/20 0.42
ACHE P22303 1/20 0.41
TYMP P19971 1/20 0.39
ERN1 O75460 1/20 0.39
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2E1 P05181 1/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2B6 P20813 1/20 0.38

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
SCHEMBL6744117 0.80 MAPT (0.44) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL7135870 0.79 MAPT (0.52) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL616338 0.78 DHODH (0.43) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL8152470 0.77 MAPT (0.41) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL21858143 0.77 HTR1A (0.43) MAPTKDM4EL3MBTL1MEN1KMT2A
SCHEMBL7138537 0.76 LTK (0.42) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL3210108 0.76 ACHE (0.35) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL155112 0.74 LTA4H (0.47) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL30410750 0.74 LTA4H (0.47) MAPTHPGDKDM4EL3MBTL1MEN1
SCHEMBL5533182 0.74 MEN1 (0.37) MAPTHPGDKDM4EL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114158553-B Novel pesticide preparation and preparation method thereof 南开沧州渤海新区绿色化工研究有限公司 2023-02-21 CN disclosed
EP-1261336-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2007-02-07 EP disclosed
EP-1261336-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-12-15 EP disclosed
EP-1161232-B1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-03-24 EP disclosed
US-6608077-B2 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease SMITHKLINE BEECHAM CORPORATION 2003-08-19 US disclosed
US-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-06-12 US disclosed
US-20030055286-A1 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease SMITHKLINE BEECHAM CORPORATION 2003-03-20 US disclosed
US-6500863-B1 INTERLEUKIN BINDING INHIBITORS SUCH AS N-(2-HYDROXYL-3-AMINO SULFONYL-4-CHLOROPHENYL)-N'-(2-BROMOPHENYL)UREA, USED FOR PROPHYLAXIS OF CHEMOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION 2002-12-31 US disclosed
EP-1261336-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-04 EP disclosed
WO-2001068568-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 (2 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-20030055286-A1 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease CXCL8, CCR8, CCL2 MAPT 2058/4885HPGD 1528/4885KDM4E 3956/4885
US-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists CXCL8, CCR8, IL18 MAPT 3345/4885HPGD 630/4885KDM4E 4081/4885

“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.