SCHEMBL9264377

SCHEMBL9264377

NC(=O)C(CCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.50
ERAP1 Q9NZ08 2/20 0.50
MMP8 P22894 2/20 0.50
ERAP2 Q6P179 1/20 0.50
KMT2A Q03164 1/20 0.49
MME P08473 1/20 0.49
GRIK1 P39086 1/20 0.47
CNR2 P34972 1/20 0.47
TSHR P16473 1/20 0.47
EPHX1 P07099 1/20 0.47
ALPI P09923 1/20 0.47
PKM P14618 1/20 0.47
PTGS1 P23219 1/20 0.47
XIAP P98170 1/20 0.47
SLC7A5 Q01650 1/20 0.47
KEAP1 Q14145 1/20 0.47
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL341788 0.94 ANPEP (0.52) ANPEPERAP1MMP8ERAP2KMT2A
SCHEMBL10419193 0.89 GRIK1 (0.57) MMP8GRIK1EPHX1MMP2
SCHEMBL2291948 0.87 MMP8 (0.56) ANPEPERAP1MMP8ERAP2MME
SCHEMBL18424616 0.87 ALDH1A1 (0.48) ANPEPERAP1MMP8ERAP2KMT2A
SCHEMBL10419292 0.85 MAPT (0.53) GRIK1
SCHEMBL27541296 0.84 MMP8 (0.44) ANPEPERAP1MMP8ERAP2KMT2A
SCHEMBL28107772 0.82 ERAP1 (0.52) ANPEPERAP1ERAP2GRIK1CNR2
SCHEMBL3067055 0.81 MMP8 (0.52) MMP8KMT2ATSHR
SCHEMBL8197537 0.81 CNR2 (0.49) ANPEPERAP1MMP8ERAP2GRIK1
SCHEMBL25415614 0.80 MMP8 (0.55) MMP8KMT2AMMETSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5466708-A Carbamyloxyoxetanone compounds HOFFMANN-LA ROCHE INC. (US) 1995-11-14 US disclosed
US-5376674-A Lipase inhibitors HOFFMAN-LA ROCHE INC. (US) 1994-12-27 US disclosed
US-5260310-A Oxetanone compounds and pharmaceutical compositions containing them HOFFMANN-LA ROCHE INC. (US) 1993-11-09 US disclosed