SCHEMBL701139

SCHEMBL701139

Nc1cc(Oc2ccc(NC(=O)c3cccn(-c4ccc(F)cc4)c3=O)cc2F)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 1.00
RIPK3 Q9Y572 6/20 0.79
RIPK1 Q13546 5/20 0.74
RIPK2 O43353 4/20 0.74
CYP3A4 P08684 1/20 0.73
CYP2C9 P11712 1/20 0.73
AXL P30530 4/20 0.68
LCK P06239 1/20 0.68
KIT P10721 1/20 0.68
KDR P35968 1/20 0.68
FLT3 P36888 1/20 0.68
TYRO3 Q06418 1/20 0.67
MERTK Q12866 1/20 0.67

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
SCHEMBL1137050 0.94 MET (0.89) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL1137557 0.88 MET (0.79) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL23999220 0.86 MET (0.76) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL26621294 0.85 MET (0.74) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL29843369 0.85 MET (0.74) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL23999234 0.85 MET (1.00) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL1137343 0.84 MET (1.00) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL12863936 0.84 MET (0.88) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL12350006 0.83 MET (0.71) METRIPK3RIPK1RIPK2CYP3A4
SCHEMBL1137224 0.83 MET (0.71) METRIPK3RIPK1RIPK2CYP3A4

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989477-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-02 US claimed
US-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 US claimed
US-7459562-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-02 US claimed
US-8536200-B2 Pyridinone compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2013-09-17 US disclosed
EP-2089364-B1 PYRIDINONE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2013-06-12 EP disclosed
EP-2235002-B1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER BRISTOL MYERS SQUIBB CO (US) 2012-11-21 EP disclosed
US-8258118-B2 4-pyridinone compounds and their use for cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2012-09-04 US disclosed
US-8258118-B2 4-pyridinone compounds and their use for cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2012-09-04 US disclosed
US-20120114643-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER BRISTOL-MYERS SQUIBB COMPANY 2012-05-10 US disclosed
US-20120114643-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER BRISTOL-MYERS SQUIBB COMPANY 2012-05-10 US disclosed
US-8124768-B2 4-pyridinone compounds and their use for cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2012-02-28 US disclosed
US-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-02-26 US disclosed
US-7459562-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-02 US disclosed
US-7459562-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-02 US disclosed
US-7459562-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-02 US disclosed
WO-2008058229-A1 PYRIDINONE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-15 WO disclosed
US-20080114033-A1 N-(4-(2-Amino-3-chloropyridin-4-yloxy)-3-fluorophenyl)-4-ethoxy-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide; Met kinase inhibitor; hypatocyte growth factor antagonist; anticarcinogenic agent BRISTOL-MYERS SQUIBB COMPANY 2008-05-15 US disclosed
EP-1737451-A2 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2007-01-03 EP disclosed
WO-2005117867-A2 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-15 WO disclosed
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-11-03 US 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 (5 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-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 MET 162/4885RIPK3 489/4885RIPK1 558/4885
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors CDK2, MAP3K19, CDK1 MET 162/4885RIPK3 489/4885RIPK1 558/4885
US-20080114033-A1 N-(4-(2-Amino-3-chloropyridin-4-yloxy)-3-fluorophenyl)-4-ethoxy-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide; Met kinase inhibitor; hypatocyte growth factor antagonist; anticarcinogenic agent MET, HGF, DCK MET 1/4885RIPK3 1015/4885RIPK1 918/4885
US-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 MET 162/4885RIPK3 489/4885RIPK1 558/4885
US-20120114643-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER DPYD, CDK4, G6PD MET 3606/4885RIPK3 3842/4885RIPK1 4044/4885

“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.