SCHEMBL28052545

SCHEMBL28052545

O=C(Oc1ccc(Br)cc1)N1CCc2ccccc2C1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.66
▸ GAA P10253 1/20 0.66
▸ TDP1 Q9NUW8 1/20 0.66
▸ NPC1 O15118 4/20 0.59
▸ RAB9A P51151 4/20 0.59
▸ LIPE Q05469 1/20 0.56
▸ NOTUM Q6P988 1/20 0.53
▸ ABHD6 Q9BV23 1/20 0.52
▸ PDE4B Q07343 1/20 0.52
▸ TAAR1 Q96RJ0 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ ACHE P22303 1/20 0.49
▸ HPGD P15428 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ TSHR P16473 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48

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
SCHEMBL15878542 0.90 TDP1 (0.55) MAPTGAATDP1NPC1RAB9A
SCHEMBL29589853 0.88 SMN1; SMN2 (0.59) MAPTGAATDP1NPC1RAB9A
SCHEMBL15355311 0.88 SMN1; SMN2 (0.59) MAPTGAATDP1NPC1RAB9A
SCHEMBL29591000 0.86 RAB9A (0.59) MAPTNPC1RAB9ALIPENOTUM
SCHEMBL28826015 0.86 LIPE (0.62) MAPTGAATDP1LIPENOTUM
SCHEMBL29560919 0.86 L3MBTL1 (0.66) MAPTGAATDP1NPC1RAB9A
SCHEMBL29698174 0.82 HPGD (0.68) MAPTNPC1RAB9APDE4BMEN1
SCHEMBL13647708 0.82 HPGD (0.54) MAPTGAATDP1NPC1RAB9A
SCHEMBL8247508 0.82 HPGD (0.68) MAPTNPC1RAB9APDE4BMEN1
SCHEMBL28825992 0.80 RAB9A (0.62) MAPTGAANPC1RAB9ALIPE

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
CN-105431422-A Isoindoline or isoquinoline compounds, process for their preparation and pharmaceutical compositions containing them SERVIER LAB 2016-03-23 — — CN disclosed
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