SCHEMBL4475239

SCHEMBL4475239

NS(=O)(=O)c1ccc(Nc2cc(-c3ccc(F)cc3)n[nH]2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 6/20 0.62
MEN1 O00255 1/20 0.56
MAPT P10636 1/20 0.56
MAPK1 P28482 1/20 0.56
KMT2A Q03164 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
SOS1 Q07889 4/20 0.50
CDK1 P06493 3/20 0.49
PTGS2 P35354 2/20 0.49
MAP2K7 O14733 1/20 0.48
MAP2K4 P45985 1/20 0.48
CA2 P00918 5/20 0.47
CA1 P00915 4/20 0.47
PTGS1 P23219 1/20 0.47
CA9 Q16790 4/20 0.46
CA12 O43570 2/20 0.46
CA4 P22748 2/20 0.46
CA7 P43166 2/20 0.46
CA6 P23280 1/20 0.45
CA13 Q8N1Q1 1/20 0.45

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
SCHEMBL4466766 0.88 CDK2 (0.62) CDK2SOS1CDK1CA2CA1
SCHEMBL5510994 0.87 CA12 (0.50) CDK2MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL13931766 0.87 CDK2 (0.48) CDK2MEN1MAPTMAPK1KMT2A
SCHEMBL4476707 0.87 CDK2 (0.62) CDK2SOS1CDK1PTGS2CA2
SCHEMBL13918111 0.87 IKBKB (0.54) CDK2MEN1MAPTKMT2ACDK1
Gw831091X SCHEMBL4464647 0.85 CDK2 (0.65) CDK2MEN1MAPTMAPK1KMT2A
SCHEMBL13931858 0.85 CDK2 (0.46) CDK2MEN1MAPTMAPK1KMT2A
SCHEMBL4460780 0.84 CDK2 (0.65) CDK2MEN1MAPTMAPK1KMT2A
SCHEMBL4466135 0.82 CDK2 (0.68) CDK2MEN1MAPTMAPK1KMT2A
SCHEMBL4467252 0.80 CDK2 (0.64) CDK2MEN1MAPTMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507834-B2 Substituted anilinopyrazoles SMITHKLINE BEECHAN CORPORATION (US) 2009-03-24 US claimed
EP-1597234-B1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-10-08 EP claimed
EP-1597234-A4 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-11-21 EP claimed
US-20060142284-A1 Novel compounds SMITHKLINE BEECHAM CORPORATION 2006-06-29 US claimed
EP-1597234-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2005-11-23 EP claimed
WO-2004076414-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-09-10 WO claimed
US-7507834-B2 Substituted anilinopyrazoles SMITHKLINE BEECHAN CORPORATION (US) 2009-03-24 US disclosed
US-7507834-B2 Substituted anilinopyrazoles SMITHKLINE BEECHAN CORPORATION (US) 2009-03-24 US disclosed
US-7507834-B2 Substituted anilinopyrazoles SMITHKLINE BEECHAN CORPORATION (US) 2009-03-24 US disclosed
EP-1597234-B1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-10-08 EP disclosed
EP-1597234-A4 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-11-21 EP disclosed
US-20060142284-A1 Novel compounds SMITHKLINE BEECHAM CORPORATION 2006-06-29 US disclosed
EP-1597234-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2005-11-23 EP disclosed
WO-2004076414-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-09-10 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-20060142284-A1 Novel compounds CDK2, CDK3, CDK2AP2 CDK2 1/4885MEN1 2277/4885MAPT 3157/4885

“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.