SCHEMBL9848971

SCHEMBL9848971

CC(C)CC1C(=O)N(C)C(Cc2cn(C)c3ccccc23)C(=O)N1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GPR84 Q9NQS5 1/20 0.37
CMA1 P23946 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTR2A P28223 1/20 0.34
LMNA P02545 2/20 0.34
CA2 P00918 1/20 0.33
GRM2 Q14416 1/20 0.33
GRM3 Q14832 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL9026142 1.00 CCKBR (0.38) CCKBRMEN1KMT2AGPR84CMA1
SCHEMBL9025971 1.00 CCKBR (0.38) CCKBRMEN1KMT2AGPR84CMA1
SCHEMBL9026074 0.82 KMT2A (0.47) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL9026218 0.82 KMT2A (0.47) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL9026403 0.80 KDM4E (0.43) CCKBRMEN1KMT2AGPR84CMA1
SCHEMBL9026865 0.80 KDM4E (0.43) CCKBRMEN1KMT2AGPR84CMA1
SCHEMBL9026296 0.72 TACR3 (0.42)
SCHEMBL10466586 0.70 GPR84 (0.46) CCKBRKMT2AGPR84CMA1KDM4E
SCHEMBL10467137 0.67 HDAC3 (0.48) CCKBRMEN1KMT2AGPR84CMA1
SCHEMBL10467623 0.66 GPR84 (0.43) CCKBRMEN1KMT2AGPR84CMA1

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
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed