SCHEMBL28947331

SCHEMBL28947331

CCOC(=O)c1csc(Cc2c(C)c3cc(C(F)(F)F)ccc3n2S(=O)(=O)CC=Cc2cccc(C(C)(C)C)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ KDR P35968 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ APP P05067 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CACNA1B Q00975 1/20 0.33
▸ APBA1 Q02410 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ GRM5 P41594 1/20 0.32
▸ PTGER1 P34995 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MMP1 P03956 1/20 0.31

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
SCHEMBL28807365 0.92 PTGER1 (0.40) KDM4EPTGER1
SCHEMBL28810374 0.88 MAPT (0.37) MAPTKDM4EKDRAPPADORA1
SCHEMBL27936061 0.86 MAPT (0.36) MAPTKDM4EKDRHIF1AAPP
SCHEMBL12096843 0.85 HIF1A (0.41) MAPTKDM4EKDRHIF1AAPP
SCHEMBL28947517 0.80 HTT (0.33) MAPTKDM4EHIF1AMEN1KMT2A
SCHEMBL27936040 0.79 ITK (0.33) MAPTKDM4E
SCHEMBL27950237 0.79 MEN1 (0.37) MEN1KMT2ANPC1RAB9A
SCHEMBL27936131 0.78 MRGPRX4 (0.37) MEN1KMT2ANPC1RAB9A
SCHEMBL27936035 0.78 PTGER1 (0.39) MAPTKDM4EPTGER1TP53
SCHEMBL12096702 0.76 PTGER1 (0.43) MAPTPTGER1TP53

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
CN-103554006-A Use of indole derivatives as nurr-1 activators for the application thereof as a medicament for the treatment of parkinson's disease FOURNIER LAB SA 2014-02-05 — — CN claimed
CN-103554006-A Use of indole derivatives as nurr-1 activators for the application thereof as a medicament for the treatment of parkinson's disease FOURNIER LAB SA 2014-02-05 — — CN disclosed
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