SCHEMBL6570490

SCHEMBL6570490

Cc1ccc(NC(=O)c2cccc(N3CCOCC3)c2)cc1-c1c(OC2CCN(C(=O)OC(C)(C)C)CC2)cccc1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 16/20 0.47
BRAF P15056 16/20 0.47
OPRK1 P41145 1/20 0.46
MAPK14 Q16539 3/20 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
SCHEMBL6572676 0.96 RAF1 (0.46) RAF1BRAFOPRK1MAPK14
SCHEMBL6574089 0.93 OPRK1 (0.44) RAF1BRAFOPRK1
SCHEMBL6572660 0.92 BRAF (0.48) RAF1BRAFMAPK14
SCHEMBL6572665 0.91 RAF1 (0.49) RAF1BRAF
SCHEMBL6574087 0.90 RAF1 (0.44) RAF1BRAFOPRK1MAPK14
SCHEMBL6571705 0.88 OPRK1 (0.51) RAF1BRAFOPRK1MAPK14
SCHEMBL6477326 0.82 MAPK14 (0.54) OPRK1MAPK14
SCHEMBL6476766 0.81 OPRK1 (0.59) RAF1BRAFOPRK1MAPK14
SCHEMBL6476511 0.80 MAPK14 (0.62) RAF1BRAFOPRK1MAPK14
SCHEMBL27483070 0.79 RAF1 (0.55) RAF1BRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077931-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-17 EP disclosed