SCHEMBL11205973

SCHEMBL11205973

CC(CC(C)OC(=O)CC(=O)O)OC(=O)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.38
FAAH O00519 4/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
LDHA P00338 1/20 0.36
SRR Q9GZT4 1/20 0.36
TSHR P16473 3/20 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
MMP13 P45452 1/20 0.33
FOLH1 Q04609 6/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31

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
SCHEMBL4009823 0.93 CYP19A1 (0.44) CYP19A1FAAHCNR1CNR2MMP1
SCHEMBL25171671 0.86 FAAH (0.36) CYP19A1FAAHCNR1CNR2MAPT
SCHEMBL11880078 0.84 FAAH (0.36) FAAHCNR1CNR2LDHASRR
SCHEMBL151702 0.84 FAAH (0.40) FAAHCNR1CNR2LDHASRR
SCHEMBL28875951 0.82 MAPT (0.39) FAAHCNR1CNR2LDHASRR
Ethane SCHEMBL15437842 0.82 FAAH (0.39) FAAHCNR1CNR2LDHASRR
SCHEMBL7027311 0.82 FAAH (0.39) FAAHCNR1CNR2LDHASRR
SCHEMBL28314576 0.82 FAAH (0.39) FAAHCNR1CNR2LDHASRR
Hydrochloric Acid SCHEMBL10612981 0.82 FAAH (0.39) FAAHCNR1CNR2LDHASRR
Methane SCHEMBL15437870 0.82 FAAH (0.39) FAAHCNR1CNR2LDHASRR

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-0090673-A2 Image-forming elements KONICA CORPORATION (JP) 1983-10-05 EP disclosed