SCHEMBL13855372

SCHEMBL13855372

Cc1cccc(Cl)c1NC(=O)Nc1cc(NC2CCC(O)CC2)ncn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 9/20 0.50
MAPK14 Q16539 3/20 0.50
EGFR P00533 5/20 0.49
FGFR1 P11362 4/20 0.49
BRD4 O60885 1/20 0.46
MAPK7 Q13164 1/20 0.46
DRD4 P21917 1/20 0.43
S1PR1 P21453 3/20 0.42
S1PR5 Q9H228 1/20 0.42
SRC P12931 3/20 0.42
ABL1 P00519 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
BRAF P15056 1/20 0.42
KDR P35968 1/20 0.42
EPHB4 P54760 1/20 0.42
TEK Q02763 1/20 0.42
FYN P06241 2/20 0.41
MAPK13 O15264 1/20 0.41
HCK P08631 1/20 0.41

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
SCHEMBL374627 1.00 LCK (0.50) LCKMAPK14EGFRFGFR1BRD4
SCHEMBL374628 1.00 LCK (0.50) LCKMAPK14EGFRFGFR1BRD4
SCHEMBL582850 0.92 EGFR (0.53) EGFRFGFR1BRD4MAPK7S1PR1
SCHEMBL582849 0.92 EGFR (0.53) EGFRFGFR1BRD4MAPK7S1PR1
SCHEMBL13855374 0.92 EGFR (0.53) EGFRFGFR1BRD4MAPK7S1PR1
SCHEMBL13855371 0.84 EGFR (0.44) LCKMAPK14EGFRFGFR1S1PR1
SCHEMBL374247 0.84 EGFR (0.44) LCKMAPK14EGFRFGFR1S1PR1
SCHEMBL374248 0.84 EGFR (0.44) LCKMAPK14EGFRFGFR1S1PR1
SCHEMBL374417 0.82 S1PR1 (0.43) MAPK14EGFRFGFR1BRD4MAPK7
SCHEMBL374416 0.82 S1PR1 (0.43) MAPK14EGFRFGFR1BRD4MAPK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552002-B2 3-(2,6-Dichloro-3,5-dimethoxy-phenyl)-1-[6-(2,6-dimethyl-pyridin-3-ylamino)-pyrimidin-4-yl]-1-methyl-urea; 3-(2,6-Dichloro-3,5-dimethoxy-phenyl)-1-methyl-1-{6-[4-(4-methyl-piperazin-1-yl)-phenylamino]-pyrimidin-4-yl}-urea NOVARTIS AG (CH) 2013-10-08 US disclosed
US-8552002-B2 3-(2,6-Dichloro-3,5-dimethoxy-phenyl)-1-[6-(2,6-dimethyl-pyridin-3-ylamino)-pyrimidin-4-yl]-1-methyl-urea; 3-(2,6-Dichloro-3,5-dimethoxy-phenyl)-1-methyl-1-{6-[4-(4-methyl-piperazin-1-yl)-phenylamino]-pyrimidin-4-yl}-urea NOVARTIS AG (CH) 2013-10-08 US disclosed
EP-2409969-B1 Pyrimidine urea derivatives as kinase inhibitors NOVARTIS AG (CH) 2013-07-24 EP disclosed
US-20130012476-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2013-01-10 US disclosed
US-20130012704-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS DING QIANG (CN) 2013-01-10 US disclosed
US-20090137804-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-05-28 US disclosed
US-20090137804-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-05-28 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 (3 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-20130012476-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, CDK1 LCK 120/4885MAPK14 325/4885EGFR 397/4885
US-20130012704-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, CDK1 LCK 120/4885MAPK14 325/4885EGFR 397/4885
US-20090137804-A1 Compounds and Compositions as Protein Kinase Inhibitors MAP3K20, MAP3K1, CDK1 LCK 120/4885MAPK14 325/4885EGFR 397/4885

“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.