SCHEMBL4383598

SCHEMBL4383598

Cc1cnc(-c2ccc(C)c(-c3ccc4c(c3)NC(=O)C43C=COCC3)c2)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.68
RAF1 P04049 1/20 0.42
NTRK1 P04629 1/20 0.42
HTR1B P28222 1/20 0.42

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
SCHEMBL1233583 0.81 MAPK14 (1.00) MAPK14RAF1NTRK1HTR1B
SCHEMBL1233180 0.66 MAPK14 (0.66) MAPK14RAF1NTRK1HTR1B
SCHEMBL1233406 0.66 MAPK14 (0.69) MAPK14RAF1NTRK1HTR1B
SCHEMBL2076446 0.66 MAPK14 (0.74) MAPK14RAF1NTRK1HTR1B
SCHEMBL12782861 0.66 MAPK14 (1.00) MAPK14RAF1NTRK1HTR1B
SCHEMBL2075955 0.65 MAPK14 (1.00) MAPK14RAF1NTRK1HTR1B
SCHEMBL2073330 0.64 MAPK14 (0.69) MAPK14RAF1NTRK1HTR1B
SCHEMBL1233622 0.64 MAPK14 (0.68) MAPK14RAF1
SCHEMBL1233438 0.63 MAPK14 (0.64) MAPK14RAF1NTRK1HTR1B
SCHEMBL2074554 0.63 MAPK14 (0.63) MAPK14RAF1

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
WO-2009124692-A1 NEW SUBSTITUTED SPIRO[CYCLOALKYL-1,3'-INDOL]-2'(1'H)-ONE DERIVATIVES AND THEIR USE AS P38 MITOGEN-ACTIVATED KINASE INHIBITORS. ALMIRALL, S.A. (ES) 2009-10-15 WO disclosed