SCHEMBL11751650

SCHEMBL11751650

CCCCCCCCN(CCCCCCCC)CC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
AGTR1 P30556 1/20 0.53
ICMT O60725 2/20 0.52
ALB P02768 2/20 0.52
THRA P10827 3/20 0.50
THRB P10828 3/20 0.50
CES2 O00748 2/20 0.50
CES1 P23141 2/20 0.50
KCNH2 Q12809 1/20 0.49
NAAA Q02083 1/20 0.49
NPC1 O15118 1/20 0.48
JAK2 O60674 1/20 0.48
RAB9A P51151 1/20 0.48
PAX8 Q06710 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KMT2A Q03164 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
SCHEMBL11749346 1.00 MAPT (0.53) MAPTKDM4EALDH1A1AGTR1ICMT
SCHEMBL11745805 1.00 MAPT (0.53) MAPTKDM4EALDH1A1AGTR1ICMT
SCHEMBL11754086 1.00 MAPT (0.53) MAPTKDM4EALDH1A1AGTR1ICMT
SCHEMBL11749501 0.98 KDM4E (0.54) MAPTKDM4EALDH1A1AGTR1ICMT
SCHEMBL11749642 0.93 KDM4E (0.56) MAPTKDM4EALDH1A1AGTR1THRA
SCHEMBL4097123 0.86 MAPT (0.59) MAPTKDM4EALDH1A1AGTR1CES2
SCHEMBL11749468 0.84 KCNH2 (0.51) THRATHRBKCNH2
SCHEMBL11745793 0.84 KCNH2 (0.51) THRATHRBKCNH2
SCHEMBL11749359 0.84 THRA (0.51) ALDH1A1THRATHRBNPC1RAB9A
SCHEMBL11749967 0.84 THRA (0.51) ALDH1A1THRATHRBNPC1RAB9A

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
US-4048034-A Photopolymerization using an alpha-aminoacetophenone UOP INC. (US) 1977-09-13 US disclosed