SCHEMBL20111728

SCHEMBL20111728

CC1=CCN(S(=O)(=O)C2CN(C(C)C)C2)CC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
GAA P10253 1/20 0.35
THRB P10828 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL20111630 0.90 JAK2 (0.33) LMNAGAA
SCHEMBL21732946 0.81 LMNA (0.30) LMNAGAA
SCHEMBL17888259 0.80 JAK1 (0.36) LMNATHRBL3MBTL1
SCHEMBL17888199 0.78 CHRM4 (0.33) LMNATHRBL3MBTL1
SCHEMBL17888250 0.78 CHRM4 (0.35) LMNATHRBL3MBTL1
SCHEMBL17888204 0.74 NAMPT (0.44) LMNAGAATHRBL3MBTL1
SCHEMBL20111910 0.72 LMNA (0.31) LMNAGAA
SCHEMBL20111907 0.72 L3MBTL1 (0.31) L3MBTL1
SCHEMBL12286066 0.71 TDO2 (0.43) LMNATHRBL3MBTL1
SCHEMBL1109602 0.70 LMNA (0.41) LMNAGAA

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-2018078360-A1 MODULATORS OF HEDGEHOG (HH) SIGNALLING PATHWAY E-THERAPEUTICS PLC (GB) 2018-05-03 WO disclosed