SCHEMBL16708592

SCHEMBL16708592

C=C1C=C(c2ccccc2)OC1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
MAPT P10636 7/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
KDM4E B2RXH2 3/20 0.49
PKM P14618 2/20 0.49
ALOX12 P18054 2/20 0.49
POLB P06746 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD17B10 Q99714 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.46
RAB9A P51151 3/20 0.46
HTT P42858 3/20 0.46
NPC1 O15118 2/20 0.46
HPGD P15428 2/20 0.46
GAA P10253 1/20 0.46
LMNA P02545 4/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.39

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
SCHEMBL22111697 0.79 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL28484432 0.77 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL6557145 0.74 CYP2A6 (0.34) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL15326875 0.69 SMN1; SMN2 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL16080106 0.68 MAPT (0.62) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL21821635 0.67 MEN1 (0.48) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL21821633 0.67 MEN1 (0.48) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL14252781 0.67 BACE1 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3201143 0.64 BACE1 (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3345116 0.63 MAPT (0.48) ALDH1A1MAPTKMT2AKDM4EHSD17B10

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-20150129861-A1 ORGANIC MATERIAL FOR DEPOSITION, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, DEPOSITION METHOD, AND MANUFACTURING METHOD FOR ORGANIC PHOTOELECTRONIC ONVERSION ELEMENT OBTAINED USING THE SAME FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed