SCHEMBL22014087

SCHEMBL22014087

O=C1c2ccccc2C(O)N1C(CO)CO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 5/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PKM P14618 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 3/20 0.43
TP53 P04637 2/20 0.43
STAT3 P40763 1/20 0.40
STAT1 P42224 1/20 0.40
KCNA5 P22460 1/20 0.38
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL21019432 0.88 MEN1 (0.43) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL4471060 0.79 MEN1 (0.51) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL21583755 0.74 KMT2A (0.47) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL20195031 0.74 HPGD (0.39) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL21669441 0.73 MEN1 (0.32) MEN1KMT2AKCNA5
SCHEMBL21583744 0.72 RAB9A (0.45) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL20427974 0.72 KCNA5 (0.43) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL18576659 0.72 MME (0.44) HPGDALDH1A1MEN1KMT2AHSD17B10
SCHEMBL19790309 0.71 MEN1 (0.39) HPGDLMNARAB9AALDH1A1MEN1
SCHEMBL20924684 0.71 L3MBTL1 (0.62) HPGDLMNARAB9AALDH1A1MEN1

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-2020100959-A1 1,3,4-OXADIAZOLONE COMPOUND AND MEDICINE 日本新薬株式会社 2020-05-22 WO disclosed