SCHEMBL9118445

SCHEMBL9118445

CCOC(=O)c1sc(Br)c(Br)c1SC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
NPSR1 Q6W5P4 5/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 5/20 0.41
GAA P10253 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MC4R P32245 1/20 0.41
ALDH1A1 P00352 7/20 0.41
CYP1A2 P05177 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
HPGD P15428 2/20 0.40
GSK3B P49841 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL21612061 0.82 MAPT (0.46) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL5271074 0.81 MAPT (0.53) LMNAKMT2AMEN1MAPTGAA
SCHEMBL20598163 0.78 MAPT (0.42) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL5727280 0.78 MAPT (0.42) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL6345016 0.77 MAPT (0.41) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL29980612 0.76 KMT2A (0.55) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL12483037 0.75 MAPT (0.50) LMNAKMT2AMEN1MAPTGAA
SCHEMBL9117738 0.74 GPR35 (0.48) ALDH1A1HPGDGSK3BKDM4ETSHR
SCHEMBL6345019 0.73 KMT2A (0.41) LMNANPSR1KMT2AMEN1MAPT
SCHEMBL28907995 0.72 MAPT (0.65) LMNAKMT2AMEN1MAPTGAA

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
WO-1995025105-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD (GB) 1995-09-21 WO disclosed