SCHEMBL1408441

SCHEMBL1408441

CCc1ccccc1-n1nc(C(C)(C)C)cc1N

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.42
MAPK13 O15264 8/20 0.42
MAPK12 P53778 8/20 0.42
MAPK11 Q15759 8/20 0.42
GRN P28799 1/20 0.42
SORT1 Q99523 1/20 0.42
JAK2 O60674 1/20 0.41
DDR2 Q16832 1/20 0.39
OPRM1 P35372 1/20 0.39
CDK8 P49336 1/20 0.38
HPGD P15428 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 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
SCHEMBL13652991 0.85 CDK8 (0.42) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL1013289 0.81 ALDH1A1 (0.56) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL29397663 0.80 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL1011502 0.80 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL15007938 0.80 GRN (0.43) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL31388014 0.80 MAPK14 (0.40) MAPK14MAPK13MAPK12MAPK11GRN
Hydrochloric Acid SCHEMBL1492473 0.80 ALDH1A1 (0.55) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL1015406 0.80 MAPK14 (0.40) MAPK14MAPK13MAPK12MAPK11GRN
SCHEMBL31457163 0.80 CYP1A2 (0.57) OPRM1ALDH1A1MAPT
SCHEMBL1814517 0.80 CYP1A2 (0.57) OPRM1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120184561-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2012-07-19 US disclosed
US-8030311-B2 Phenylacetamides suitable as protein kinase inhibitors NOVARTIS AG (CH) 2011-10-04 US disclosed
EP-1874770-B1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-03-09 EP disclosed
US-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors NOVARTIS AG (CH) 2008-12-25 US disclosed
EP-1874770-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS Novartis Pharma AG (CH) 2008-01-09 EP disclosed
WO-2006108640-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2006-10-19 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-20120184561-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS MAP3K10, MAP3K20, MAP3K9 MAPK14 81/4885MAPK13 161/4885MAPK12 122/4885
US-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors MAP3K20, MAP3K10, MAP3K9 MAPK14 80/4885MAPK13 148/4885MAPK12 111/4885

“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.