SCHEMBL9842384

SCHEMBL9842384

O=COCN1CSc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
MAPT P10636 5/20 0.34
TP53 P04637 2/20 0.34
ALDH1A1 P00352 6/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
NOTUM Q6P988 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
GSK3B P49841 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B3 P37058 1/20 0.31

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
SCHEMBL9842375 0.77 MAPT (0.34) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL9842388 0.75 HDAC1 (0.40) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL11995110 0.75 HDAC1 (0.37) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL27694440 0.73 NOTUM (0.37) MAPTALDH1A1NOTUMNPSR1KDM4E
SCHEMBL9842393 0.72 NOTUM (0.39) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL28239673 0.72 HDAC1 (0.35) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL9842129 0.72 HDAC1 (0.35) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL9842125 0.72 MAPT (0.35) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL3795637 0.72 KDM1A (0.40) HDAC1HDAC6MAPTTP53ALDH1A1
SCHEMBL11430084 0.71 HDAC1 (0.36) HDAC1HDAC6MAPTTP53ALDH1A1

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
EP-0452811-A2 Package of photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1991-10-23 EP disclosed