SCHEMBL4350048

SCHEMBL4350048

CC(C)NCCNc1[c]ccc(S(C)(=O)=O)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.32
ADRB3 P13945 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
ALDH1A1 P00352 3/20 0.31
MAPT P10636 1/20 0.31
CLK1 P49759 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
SCHEMBL1355114 0.81 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL4361967 0.78 TOP2B (0.38) ALDH1A1
SCHEMBL1355590 0.77 DRD2 (0.40) KAT2BMAPT
SCHEMBL1355874 0.76 SIGMAR1 (0.41) KAT2BMAPT
SCHEMBL1356124 0.71 ALDH1A1 (0.46) ALDH1A1MAPT
SCHEMBL1353730 0.69 SLC6A9 (0.41) ALDH1A1
SCHEMBL4357467 0.69 KAT2B (0.34) KAT2BADRB3MAPT
SCHEMBL941266 0.67 G6PD (0.37) ALDH1A1MAPT
SCHEMBL6290726 0.65 ALDH1A1 (0.41) ALDH1A1MAPT
SCHEMBL21659151 0.64 MEN1 (0.45) ALDH1A1

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-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed