SCHEMBL9692603

SCHEMBL9692603

CCCCCCCOCCCOCCCCNc1cc(C(=S)NCCCSC)ccc1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
RECQL P46063 1/20 0.36
POLB P06746 2/20 0.35
MGLL Q99685 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 2/20 0.34
HCAR3 P49019 1/20 0.33
MAPT P10636 4/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 3/20 0.32
EPHX2 P34913 1/20 0.32

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
SCHEMBL9502309 0.99 ACAT1 (0.37) ACAT1LMNAHTTRECQLPOLB
SCHEMBL9692984 0.89 ACAT1 (0.38) ACAT1LMNAPOLBMGLLL3MBTL1
SCHEMBL9503117 0.89 ACAT1 (0.38) ACAT1LMNAPOLBMGLLL3MBTL1
SCHEMBL9505690 0.86 L3MBTL1 (0.41) ACAT1LMNAHTTPOLBL3MBTL1
SCHEMBL9505639 0.84 HPGD (0.34) ACAT1LMNAHTTPOLBL3MBTL1
SCHEMBL9503202 0.83 KMT2A (0.36) ACAT1HTTL3MBTL1HPGDMAPT
SCHEMBL9506112 0.78 ACAT1 (0.39) ACAT1HTTL3MBTL1HPGDMAPT
SCHEMBL9692556 0.78 HDAC3 (0.43) LMNAHTTRECQLPOLBL3MBTL1
SCHEMBL9503973 0.77 ACAT1 (0.60) ACAT1LMNAPOLBL3MBTL1HPGD
SCHEMBL9692890 0.77 SMN1; SMN2 (0.41) ACAT1LMNAHTTPOLBL3MBTL1

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-1992003412-A2 BENZAMIDE DERIVATIVES RHONE-POULENC RORER LIMITED (GB) 1992-03-05 WO disclosed