SCHEMBL7841389

SCHEMBL7841389

Cc1ccc(NC(=O)c2ccnc(N3CCOCC3)c2)cc1Nc1ccc(CCl)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.71
RAF1 P04049 1/20 0.57
BRAF P15056 1/20 0.57
MAPK13 O15264 1/20 0.56
HSPB1 P04792 1/20 0.56
MAPK12 P53778 1/20 0.56
MAPK11 Q15759 1/20 0.56

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
SCHEMBL7680447 0.93 MAPK14 (0.69) MAPK14RAF1BRAFMAPK13HSPB1
SCHEMBL7840747 0.92 MAPK14 (0.70) MAPK14RAF1BRAF
SCHEMBL7838063 0.91 MAPK14 (0.67) MAPK14RAF1BRAF
SCHEMBL7835554 0.88 MAPK14 (0.68) MAPK14RAF1BRAF
SCHEMBL6978618 0.88 MAPK14 (0.65) MAPK14RAF1BRAFMAPK13HSPB1
SCHEMBL6967919 0.85 MAPK14 (0.68) MAPK14RAF1BRAFMAPK13HSPB1
SCHEMBL7838506 0.84 MAPK14 (0.70) MAPK14RAF1BRAF
SCHEMBL5897801 0.83 MAPK14 (0.79) MAPK14RAF1BRAFMAPK13
SCHEMBL6222906 0.83 MAPK14 (1.00) MAPK14RAF1BRAF
SCHEMBL6220971 0.83 MAPK14 (1.00) MAPK14RAF1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115707-A1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-07-18 EP disclosed
WO-2000018738-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-04-06 WO disclosed