SCHEMBL3727136

SCHEMBL3727136

CCNc1ccc2nc(Oc3ccc(SC(C)C)c(C)c3C)ccc2c1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
ELANE P08246 1/20 0.30

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
SCHEMBL3717014 0.84 MAPT (0.34) MAPTELANE
SCHEMBL3720187 0.83 MAPT (0.32) MAPTELANE
SCHEMBL3720475 0.80 HTT (0.37) MAPT
SCHEMBL3727694 0.80 MAPT (0.32) MAPT
SCHEMBL3720162 0.79 ALDH1A1 (0.31)
SCHEMBL3727138 0.79 TSHR (0.34)
SCHEMBL3716747 0.78 MAPT (0.39) MAPTELANE
SCHEMBL3720159 0.77 PDE4B (0.42) MAPT
SCHEMBL3720627 0.76 MTNR1A (0.50) MAPT
SCHEMBL3720626 0.76 ACACB (0.37)

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-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed