SCHEMBL13374337

SCHEMBL13374337

CC(C)(C)C1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.55
ACHE P22303 1/20 0.55
BACE1 P56817 1/20 0.55
MGAT2 Q10469 1/20 0.54

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
SCHEMBL24663833 0.85 POLB (0.54) ACHEMGAT2
SCHEMBL13374365 0.85 MEN1 (0.55) BCHEACHEBACE1MGAT2
SCHEMBL13374346 0.85 HRH1 (0.62) BCHEACHEBACE1MGAT2
SCHEMBL22533356 0.85 MGAT2 (0.52) BCHEACHEBACE1MGAT2
SCHEMBL13602641 0.83 TEAD1 (0.53) MGAT2
SCHEMBL10236431 0.83 ACHE (0.66) BCHEACHEBACE1
SCHEMBL13374352 0.83 ALDH1A1 (0.59) ACHEMGAT2
SCHEMBL19075520 0.82 SIGMAR1 (0.49) MGAT2
SCHEMBL12437243 0.81 ALDH1A1 (0.60) ACHE
SCHEMBL5411899 0.81 HRH3 (0.73) BCHEACHEBACE1

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
US-8288381-B2 N-9 substituted purine compounds, compositions and methods of use GENENTECH, INC. (US) 2012-10-16 US disclosed