SCHEMBL12835529

SCHEMBL12835529

CC(C)NC(=O)Cc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.61
ALDH1A1 P00352 5/20 0.55
MAPT P10636 2/20 0.55
HPGD P15428 2/20 0.55
GAA P10253 2/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 3/20 0.50
POLB P06746 1/20 0.50
PSMB8 P28062 1/20 0.50
PSMB5 P28074 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
PPARA Q07869 1/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL18885276 0.95 CNR2 (0.67) CNR2ALDH1A1GAAHTTKMT2A
SCHEMBL29354330 0.86 ALDH1A1 (0.67) CNR2ALDH1A1MAPTHPGDGAA
SCHEMBL20099754 0.81 CNR2 (0.51) CNR2ALDH1A1MAPTHPGDKMT2A
SCHEMBL12809523 0.81 POLB (0.61) CNR2ALDH1A1HTTKMT2APOLB
SCHEMBL23553286 0.81 CNR2 (0.66) CNR2ALDH1A1MAPTHPGDHTT
SCHEMBL19523045 0.80 CNR2 (0.61) CNR2ALDH1A1KMT2APOLBPSMB8
SCHEMBL6136328 0.80 CNR2 (0.61) CNR2ALDH1A1KMT2APOLBPSMB8
SCHEMBL6136330 0.80 CNR2 (0.61) CNR2ALDH1A1KMT2APOLBPSMB8
SCHEMBL26309847 0.80 CNR2 (0.50) CNR2ALDH1A1MAPTHPGDKMT2A
SCHEMBL10929986 0.80 CNR2 (0.53) CNR2ALDH1A1GAAHTTKMT2A

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-2298790-A1 Daptomycin analogs as antibacterial agents Cubist Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed