SCHEMBL15538698

SCHEMBL15538698

Cn1c(=O)c(Br)cn(C(=O)O)c1=O

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
MAPT P10636 3/20 0.34
HSD17B10 Q99714 2/20 0.34
ASAH1 Q13510 1/20 0.33
NPSR1 Q6W5P4 1/20 0.31
ADORA2B P29275 1/20 0.31
ALDH1A1 P00352 2/20 0.30
GPR35 Q9HC97 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 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
SCHEMBL8544865 0.78 LMNA (0.35) LMNAMAPTHSD17B10ADORA2BALDH1A1
SCHEMBL1527119 0.73 TSHR (0.39) LMNAHSD17B10ADORA2BALDH1A1KDM4E
SCHEMBL23403850 0.62 BRD4 (0.34) KDM4E
SCHEMBL7020240 0.61 ADORA2B (0.62) LMNAMAPTADORA2BALDH1A1
SCHEMBL11720340 0.60 LMNA (0.40) LMNAMAPTHSD17B10ADORA2BALDH1A1
SCHEMBL13560809 0.58 KDM4E (0.45) LMNAMAPTHSD17B10NPSR1ALDH1A1
SCHEMBL16334986 0.58 GPR35 (0.30) GPR35
SCHEMBL3450311 0.58 GPR35 (0.37) LMNAGPR35HPGD
SCHEMBL23536738 0.58 KDM4E (0.40) HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL21957490 0.57 HSD17B10 (0.36) LMNAMAPTHSD17B10NPSR1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2875006-A1 ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS Fondazione Istituto Italiano Di Tecnologia (IT) 2015-05-27 EP disclosed
WO-2013178576-A1 ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2013-12-05 WO disclosed