SCHEMBL28800181

SCHEMBL28800181

CCc1ccc(-n2c(C)nc(C)c2C(=O)NC(C)c2ccc(C(=O)OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
PDE2A O00408 5/20 0.44
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.42
TAOK1 Q7L7X3 1/20 0.41
TAOK3 Q9H2K8 1/20 0.41
PTGER4 P35408 2/20 0.40
TP53 P04637 1/20 0.39
ACACB O00763 1/20 0.39
MAPK1 P28482 1/20 0.39
GFER P55789 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL28800180 1.00 ALDH1A1 (0.48) ALDH1A1LMNAPDE2AMAPTL3MBTL1
SCHEMBL28800167 0.91 ALDH1A1 (0.49) ALDH1A1LMNAPDE2AMAPTL3MBTL1
SCHEMBL28800169 0.91 ALDH1A1 (0.49) ALDH1A1LMNAPDE2AMAPTL3MBTL1
SCHEMBL28800141 0.91 TDP1 (0.47) ALDH1A1LMNAPDE2AMAPTPKM
SCHEMBL28800139 0.91 TDP1 (0.47) ALDH1A1LMNAPDE2AMAPTPKM
SCHEMBL28800189 0.85 PDE2A (0.48) PDE2AL3MBTL1POLBPTGER4MAPK1
SCHEMBL28800187 0.85 PDE2A (0.48) PDE2AL3MBTL1POLBPTGER4MAPK1
SCHEMBL28800183 0.83 ALDH1A1 (0.43) ALDH1A1LMNAPDE2AMAPTL3MBTL1
SCHEMBL28800155 0.80 TDP1 (0.49) ALDH1A1PTGER4MAPK1
SCHEMBL28800158 0.80 TDP1 (0.49) ALDH1A1PTGER4MAPK1

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-114790176-A Imidazole compound and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-07-26 CN disclosed