SCHEMBL16693282

SCHEMBL16693282

C=C(C)C(=O)OCc1ccc(NOC(C)(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 4/20 0.36
POLB P06746 2/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL254038 0.81 ALDH1A1 (0.50) MEN1KMT2AL3MBTL1ALDH1A1POLB
SCHEMBL16693228 0.81 CYP17A1 (0.51) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL24788141 0.80 APP (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL12769072 0.77 ALDH1A1 (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL14867062 0.77 MEN1 (0.50) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL10904059 0.77 POLB (0.44) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL16125663 0.76 ALDH1A1 (0.46) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL92326 0.76 MEN1 (0.53) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL15944747 0.76 ALDH1A1 (0.46) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL24019226 0.76 ALDH1A1 (0.46) MEN1KMT2AMAPTALDH1A1POLB

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-2015064674-A1 METHOD FOR MANUFACTURING POLYMERIZABLE UV-ABSORBING DYE 興和株式会社 2015-05-07 WO disclosed