SCHEMBL16675680

SCHEMBL16675680

CN(Cc1ccccc1)C(=O)C1CC[C@H](NC(=O)OC(C)(C)C)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM1A O60341 1/20 0.50
MAOB P27338 1/20 0.50
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48
BTK Q06187 1/20 0.47
POLB P06746 1/20 0.46
AKT1 P31749 2/20 0.46
DRD2 P14416 2/20 0.45
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
FASN P49327 2/20 0.44
REN P00797 1/20 0.43
TSHR P16473 1/20 0.43
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
KCNA3 P22001 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL16675679 1.00 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL12047039 1.00 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL4714490 0.94 KMT2A (0.52) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL4714492 0.94 KMT2A (0.52) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL5406078 0.83 BTK (0.58) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL1813191 0.81 KMT2A (0.55) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL3206911 0.80 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL3206908 0.80 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL14169340 0.79 ALDH1A1 (0.58) KMT2AL3MBTL1KDM1AMAOBCTSL
SCHEMBL31520824 0.79 KDM1A (0.57) KMT2AL3MBTL1KDM1AMAOBCTSL

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
EP-2188251-B1 ARYLSULFONAMIDES WITH ANALGESIC ACTIVITY BOEHRINGER INGELHEIM INT (DE) 2015-04-29 EP disclosed