SCHEMBL2010903

SCHEMBL2010903

CC(C)NC(=O)NC1CCN(C(=O)C2CCC(c3ccccc3)N(S(=O)(=O)c3ccccc3)C2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.43
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPC1 O15118 1/20 0.41
EPHX2 P34913 2/20 0.39
MEN1 O00255 1/20 0.39
CCR4 P51679 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39

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
SCHEMBL12631379 1.00 LMNA (0.44) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL2013818 0.88 ALDH1A1 (0.47) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631691 0.88 ALDH1A1 (0.47) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631617 0.87 ALDH1A1 (0.49) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631381 0.87 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL2052998 0.87 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL2010182 0.86 KMT2A (0.42) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631689 0.86 KMT2A (0.42) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631378 0.85 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL12631681 0.84 ALDH1A1 (0.47) LMNASMN1; SMN2ALDH1A1KMT2ARAB9A

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-2011073277-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS Kv1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO claimed