SCHEMBL3804785

SCHEMBL3804785

Cc1cc2c(n1-c1ccc(C(=O)NC(CCN3CC(C)CC(C)C3)N3CC(C)CC(C)C3)cc1)CCC(C)C2

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 18/20 0.55
LMNA P02545 13/20 0.55
THRB P10828 3/20 0.51
POLB P06746 2/20 0.51
TP53 P04637 5/20 0.49

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
SCHEMBL3324760 0.83 MAPT (0.67) MAPTLMNATHRBPOLBTP53
SCHEMBL3323572 0.73 POLB (0.66) MAPTLMNATHRBPOLBTP53
SCHEMBL3322285 0.73 MAPT (0.60) MAPTLMNATHRBPOLB
SCHEMBL3322434 0.70 MAPT (0.67) MAPTLMNATHRBPOLBTP53
SCHEMBL3325481 0.68 MAPT (0.64) MAPTLMNATHRBPOLBTP53
SCHEMBL3323736 0.68 MAPT (0.73) MAPTLMNATHRBPOLBTP53
SCHEMBL3324864 0.67 MAPT (0.71) MAPTLMNATHRBPOLBTP53
SCHEMBL3320451 0.62 MAPT (0.71) MAPTLMNATHRBPOLBTP53
SCHEMBL13980952 0.62 MAPT (0.54) MAPTLMNATHRBPOLBTP53
SCHEMBL3324720 0.61 MAPT (0.70) MAPTLMNATHRBPOLBTP53

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-2139472-A1 TETRAHYDROINDOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2010-01-06 EP disclosed
WO-2008116926-A1 TETRAHYDROINDOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2008-10-02 WO disclosed