SCHEMBL13705698

SCHEMBL13705698

Oc1ccccc1-c1ccccc1OCc1ccc(Br)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.57
APP P05067 1/20 0.53
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
MCL1 Q07820 1/20 0.45
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
PTGER1 P34995 1/20 0.43
IDO1 P14902 1/20 0.42

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
SCHEMBL13705694 0.86 MCL1 (0.56) APPRXRARXRBRXRGMCL1
SCHEMBL13460598 0.84 APP (0.53) MAOBAPPRAB9ARXRARXRB
SCHEMBL13460837 0.84 APP (0.53) MAOBAPPSMN1; SMN2RXRARXRB
SCHEMBL13460600 0.78 APP (0.46) APPRAB9ARXRARXRBRXRG
SCHEMBL13705697 0.78 MAOB (0.51) MAOBRAB9ANPC1HTTSMN1; SMN2
SCHEMBL26013299 0.74 MAPT (0.63) RXRARXRBRXRGMCL1PTGER1
SCHEMBL27317852 0.73 LMNA (0.57) RAB9AKMT2AMEN1LMNAIDO1
SCHEMBL8960607 0.73 APP (0.76) MAOBAPPRAB9ASMN1; SMN2KMT2A
SCHEMBL29563218 0.73 MAOB (1.00) MAOBAPPRAB9ANPC1HTT
SCHEMBL22103872 0.73 APP (0.69) MAOBAPPRAB9ANPC1HTT

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-2009116665-A1 PROCESS FOR PRODUCTION OF 2-HYDROXYARYL ALDEHYDE COMPOUND 日産化学工業株式会社 (JP) 2009-09-24 WO disclosed