SCHEMBL30871978

SCHEMBL30871978

O=C1Nc2c(O)cccc2OC1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 1/20 0.36
PARP1 P09874 2/20 0.34
DAO P14920 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
AR P10275 1/20 0.33
HSD11B1 P28845 1/20 0.33
AKR1C3 P42330 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
BLM P54132 1/20 0.33
PARP15 Q460N3 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32

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
SCHEMBL19429612 0.73 PARP1 (0.62) PARP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL912962 0.73 PARP1 (0.62) PARP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL29999040 0.73 PARP1 (0.62) PARP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4320359 0.69 TTR (0.42) GUSBKDM4EALDH1A1LMNACYP1A2
SCHEMBL1137855 0.67 GRM5 (0.48) PARP1ALDH1A1
SCHEMBL29999019 0.66 BRD4 (0.55) PARP1KDM4EALDH1A1MAOAMAOB
SCHEMBL22766689 0.66 KDM4E (0.38) KDM4EALDH1A1HPGD
SCHEMBL339368 0.62 ALOX5 (0.60) KDM4ELMNA
SCHEMBL31174603 0.62 ALOX5 (0.60) KDM4ELMNA
SCHEMBL3637630 0.61 PARP1 (0.56) PARP1

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
CN-117794534-A Compositions for modulating cortisol homeostasis and improving sleep quality and methods of use and preparation thereof 尤尼根公司 2024-03-29 CN disclosed