SCHEMBL14011691

SCHEMBL14011691

CCCC1(CCC)c2ccc(C(C)=O)cc2-c2ccc(Br)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ PDK2 Q15119 2/20 0.36
▸ S100A4 P26447 1/20 0.36
▸ TP53 P04637 2/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ HSD17B1 P14061 1/20 0.35
▸ MAOB P27338 4/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ SRD5A1 P18405 1/20 0.32

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
SCHEMBL5049195 0.93 PDK2 (0.42) MAPTNPC1RAB9APDK2S100A4
SCHEMBL28656781 0.83 HDAC3 (0.39) MAPTNPC1RAB9APDK2TP53
SCHEMBL29294962 0.81 PDK2 (0.37) NPC1RAB9APDK2S100A4MEN1
SCHEMBL29375527 0.81 PDK2 (0.39) NPC1RAB9APDK2S100A4MEN1
SCHEMBL1993181 0.81 PDK2 (0.39) NPC1RAB9APDK2S100A4MEN1
SCHEMBL27584898 0.81 MAPT (0.37) MAPTTP53KMT2ASRD5A1SRD5A2
SCHEMBL17084359 0.81 PDK2 (0.56) MAPTNPC1RAB9APDK2S100A4
SCHEMBL18175540 0.78 S100A4 (0.34) S100A4CA1CA2CA4CA7
SCHEMBL4341387 0.77 PDK2 (0.47) MAPTPDK2MEN1KMT2AL3MBTL1
SCHEMBL29763208 0.77 PDK2 (0.47) MAPTPDK2MEN1KMT2AL3MBTL1

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
US-7445825-B2 Donor sheet having a polymerizable, amorphous matrix with electrically active material disposed therein 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-11-04 — — US disclosed
US-7445825-B2 Donor sheet having a polymerizable, amorphous matrix with electrically active material disposed therein 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-11-04 — — US disclosed
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