SCHEMBL30697449

SCHEMBL30697449

N#Cc1ccc(Cn2ccc3cccc(C(=O)O)c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.48
PTGER4 P35408 5/20 0.45
PTGDR Q13258 4/20 0.45
SNCA P37840 2/20 0.45
PTGER2 P43116 2/20 0.44
TBXA2R P21731 1/20 0.44
PTGER1 P34995 1/20 0.44
PTGFR P43088 1/20 0.44
PTGER3 P43115 1/20 0.44
HTT P42858 3/20 0.42
LMNA P02545 2/20 0.42
NOTUM Q6P988 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
AR P10275 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
KDM4E B2RXH2 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
SCHEMBL22393055 1.00 APP (0.48) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL988096 0.85 CYP11B1 (0.52) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL7652408 0.85 NOTUM (0.56) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL987890 0.84 PTGER4 (0.51) APPPTGER4PTGDRPTGER2TBXA2R
SCHEMBL22894727 0.83 APP (0.43) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL989493 0.83 CHRM1 (0.50) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL12900317 0.83 NOTUM (0.51) APPPTGER4PTGDRPTGER2TBXA2R
SCHEMBL12900314 0.83 FABP4 (0.50) APPPTGER4PTGDRPTGER2TBXA2R
SCHEMBL988161 0.81 PTGER4 (0.50) APPPTGER4PTGDRSNCAPTGER2
SCHEMBL26432767 0.80 PRKAA2 (0.53) PTGER4PTGDRPTGER2TBXA2RPTGER1

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-110891935-B Bicyclic compounds and their use in cancer treatment 泰普斯特医疗公司 2023-12-01 CN disclosed