SCHEMBL934732

SCHEMBL934732

COc1ccccc1-c1ccc(CCCC(N)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC13A5 Q86YT5 1/20 0.55
LPAR1 Q92633 2/20 0.49
FFAR1 O14842 2/20 0.48
MME P08473 1/20 0.48
MMEL1 Q495T6 1/20 0.48
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
ICMT O60725 2/20 0.47
HPGD P15428 2/20 0.47
PLAAT3 P53816 1/20 0.46
PLAAT5 Q96KN8 1/20 0.46
PLAAT2 Q9NWW9 1/20 0.46
PLAAT4 Q9UL19 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL7236617 0.89 SLC13A5 (0.62) SLC13A5LPAR1FFAR1MMEMMEL1
SCHEMBL3677264 0.82 FFAR1 (0.66) SLC13A5FFAR1MMEMMEL1PPARG
SCHEMBL12646406 0.81 SLC13A5 (0.56) SLC13A5FFAR1MMEMMEL1PPARG
SCHEMBL934360 0.81 MME (0.45) FFAR1MMEPPARGPPARAKMT2A
SCHEMBL7357330 0.80 MME (0.55) MMEMMEL1HPGDLMNAKMT2A
SCHEMBL29411612 0.78 ALDH1A1 (0.62) FFAR1MMEPPARGPPARARAB9A
SCHEMBL6504790 0.77 SLC13A5 (0.54) SLC13A5MMEMMEL1PPARGPPARA
SCHEMBL7446944 0.77 SLC13A5 (0.55) SLC13A5FFAR1MMEMMEL1PPARG
SCHEMBL3467962 0.77 PPARG (0.54) SLC13A5LPAR1FFAR1MMEMMEL1
SCHEMBL2013598 0.77 ICMT (0.42) PPARGPPARAICMTLMNAALDH1A1

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-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 WO disclosed