SCHEMBL14547799

SCHEMBL14547799

CCCCSCC(=O)c1ccc(NC(C)=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.60
HDAC4 P56524 4/20 0.60
HDAC1 Q13547 4/20 0.60
HDAC7 Q8WUI4 4/20 0.60
HDAC2 Q92769 4/20 0.60
HDAC10 Q969S8 4/20 0.60
HDAC11 Q96DB2 4/20 0.60
HDAC8 Q9BY41 4/20 0.60
HDAC6 Q9UBN7 4/20 0.60
HDAC9 Q9UKV0 4/20 0.60
HDAC5 Q9UQL6 4/20 0.60
ALDH1A1 P00352 4/20 0.54
TP53 P04637 1/20 0.54
HIF1A Q16665 1/20 0.54
HPGD P15428 3/20 0.54
RECQL P46063 1/20 0.54
NPSR1 Q6W5P4 2/20 0.52
NPC1 O15118 2/20 0.49
HSD11B1 P28845 1/20 0.49
RAB9A P51151 3/20 0.49

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
SCHEMBL14497590 0.80 ESR1 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15935741 0.80 HSD17B3 (0.61) ALDH1A1RECQLNPC1RAB9ASMN1; SMN2
SCHEMBL4937716 0.80 ALDH1A1 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12425415 0.79 MAPT (0.56) ALDH1A1TP53HPGDRECQLSMN1; SMN2
SCHEMBL9078244 0.78 HSD17B3 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14534944 0.78 HDAC3 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8756244 0.78 ALDH1A1 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6687580 0.76 HDAC3 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14534940 0.76 HDAC3 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL3619479 0.76 ALDH1A1 (0.70) HDAC3HDAC4HDAC1HDAC7HDAC2

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-7202014-B2 Stimulus-sensitive composition, compound and pattern formation method using the stimulation-sensitive composition FUJIFILM CORPORATION (JP) 2007-04-10 US disclosed