SCHEMBL28298073

SCHEMBL28298073

N#Cc1nccc(Cl)c1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 1/20 0.36
LRRK2 Q5S007 1/20 0.36
KMO O15229 1/20 0.31
GRM5 P41594 3/20 0.31
SCD O00767 1/20 0.31
CTSK P43235 2/20 0.30
TYK2 P29597 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
CASP1 P29466 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL1007112 0.72 ALDH1A1 (0.42) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL30692909 0.72 ALDH1A1 (0.42) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL26686534 0.72 USP7 (0.35) GAAMAPT
SCHEMBL24257639 0.71 KDM4E (0.43) KDM4EALDH1A1POLB
SCHEMBL28296285 0.71 LRRK2 (0.36) KDM4EALDH1A1LRRK2MEN1GAA
SCHEMBL19798188 0.69 KDM4E (0.40) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL29672973 0.69 KDM4E (0.40) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL31727717 0.69 KDM4E (0.40) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL14783084 0.69 KDM4E (0.40) KDM4EALDH1A1POLBLRRK2KMO
SCHEMBL3095407 0.69 KDM4E (0.40) KDM4EALDH1A1POLBLRRK2KMO

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-109843891-A Oxadiazolopyridine derivatives as ghrelin O-acyltransferase (GOAT) inhibitors 勃林格殷格翰国际有限公司 2019-06-04 CN disclosed