SCHEMBL9842375

SCHEMBL9842375

O=[C]OCN1CSc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
TP53 P04637 2/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
KMT2A Q03164 2/20 0.33
NOTUM Q6P988 1/20 0.33
MITF O75030 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SLC22A12 Q96S37 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 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
SCHEMBL11430084 0.78 HDAC1 (0.36) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL9842384 0.77 HDAC1 (0.36) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL9842388 0.75 HDAC1 (0.40) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL11995110 0.75 HDAC1 (0.37) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL6006411 0.74 HDAC1 (0.36) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL29277422 0.73 SLC22A12 (0.34) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL9842393 0.72 NOTUM (0.39) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL9842125 0.72 MAPT (0.35) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL9842129 0.72 HDAC1 (0.35) MAPTHDAC1HDAC6TP53ALDH1A1
SCHEMBL3795637 0.72 KDM1A (0.40) MAPTHDAC1HDAC6TP53ALDH1A1

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 2 patents. 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
US-4237214-A P-DIHYDROXYBENZENE DEVELOPING AGENT FUJI PHOTO FILM CO., LTD. (JP) 1980-12-02 US disclosed