SCHEMBL1822182

SCHEMBL1822182

CC(C)(C)C1=C[CH]CC=C1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MCL1 Q07820 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL6335738 0.68
SCHEMBL12493226 0.67
SCHEMBL15018278 0.66
SCHEMBL15017856 0.66
SCHEMBL4657978 0.65 ATM (0.50) ALDH1A1MAPTMCL1ATM
SCHEMBL2752470 0.60
SCHEMBL3292052 0.59 MAPT (0.37) ALDH1A1MAPTMCL1ATM
SCHEMBL6686960 0.57 ALDH1A1 (0.31) ALDH1A1MAPTMCL1ATM
SCHEMBL486022 0.57
SCHEMBL4391911 0.53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536735-A1 METAL-LIGAND COMPLEXES AND CATALYSTS Dow Global Technologies LLC (US) 2012-12-26 EP disclosed
WO-2011102989-A1 METAL-LIGAND COMPLEXES AND CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2011-08-25 WO disclosed
EP-2315788-A2 METAL-LIGAND COMPLEXES AND CATALYSTS Dow Global Technologies LLC (US) 2011-05-04 EP disclosed
WO-2010022228-A2 METAL-LIGAND COMPLEXES AND CATALYSTS DOW GLOBAL TECHNOLOGIES, INC. (US) 2010-02-25 WO disclosed