SCHEMBL991992

SCHEMBL991992

[O]NC=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MAOB P27338 4/20 0.50
LMNA P02545 4/20 0.48
ALDH1A1 P00352 4/20 0.48
TRPA1 O75762 1/20 0.48
ALOX5 P09917 1/20 0.48
MAPK1 P28482 1/20 0.48
HDAC1 Q13547 5/20 0.46
HDAC2 Q92769 4/20 0.46
HDAC6 Q9UBN7 4/20 0.46
HDAC3 O15379 3/20 0.46
HDAC4 P56524 3/20 0.46
HDAC8 Q9BY41 3/20 0.46
MAPT P10636 3/20 0.46
PLIN1 O60240 2/20 0.46
RECQL P46063 2/20 0.46
PLIN5 Q00G26 2/20 0.46
ABHD5 Q8WTS1 2/20 0.46
BCHE P06276 1/20 0.46

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
SCHEMBL264894 0.78 MAOB (0.55) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL264895 0.78 MAOB (0.55) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL28852837 0.77 ALDH1A1 (0.52) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL9480701 0.77 ALDH1A1 (0.52) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL6058424 0.76 NPC1 (0.54) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL3473864 0.74 MAOB (0.50) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL6309899 0.74 MAOB (0.50) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL1507418 0.74 MAOB (0.50) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL450504 0.74 MAOB (0.50) NPC1RAB9AMAOBLMNAALDH1A1
SCHEMBL17995260 0.74 MAOB (0.50) NPC1RAB9AMAOBLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102469864-A Cosmetic article comprising an electrochromic multilayer structure OREAL 2012-05-23 CN disclosed
WO-2011001417-A1 A COSMETIC ARTICLE INCLUDING AN ELECTROCHROMIC MULTILAYER STRUCTURE L'OREAL (FR) 2011-01-06 WO disclosed
WO-2011001415-A1 A COSMETIC ARTICLE INCLUDING AN ELECTROCHROMIC MULTILAYER STRUCTURE L'OREAL (FR) 2011-01-06 WO disclosed