SCHEMBL18174485

SCHEMBL18174485

CCNC(=O)CC(=O)OCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
MCL1 Q07820 1/20 0.40
FAAH O00519 1/20 0.39
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
RAB9A P51151 2/20 0.33
HPGD P15428 1/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5205018 0.84 GAA (0.64) GAAMGAMSIMGAM2MCL1
SCHEMBL18174487 0.81 MGAM (0.35) GAAMGAMSIMGAM2
SCHEMBL18174486 0.80 MGAM (0.36) GAAMGAMSIMGAM2
SCHEMBL14898408 0.80 GAA (0.41) GAAMGAMSIMGAM2MCL1
SCHEMBL12072447 0.78 MGAM (0.48) GAAMGAMSIMGAM2MCL1
SCHEMBL18174489 0.76 MGAM (0.40) GAAMGAMSIMGAM2MCL1
Butane SCHEMBL3949759 0.75 MGAM (0.57) GAAMGAMSIMGAM2FAAH
SCHEMBL5909428 0.74 MCL1 (0.55) MCL1FAAHALDH1A1MMP1MMP2
SCHEMBL3415360 0.74 MGAM (0.53) GAAMGAMSIMGAM2TSHR
SCHEMBL10092871 0.73

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
US-9475758-B2 Compounds, method for preparation thereof and use thereof for preparing polymers useful for increasing heat resistance of polymeric compositions FAURECIA INTERIEUR INDUSTRIE (FR) 2016-10-25 US disclosed