SCHEMBL9502293

SCHEMBL9502293

CCCCCCCOCCCOCCCC(=O)Nc1cc(C(=S)NCCCS(C)(=O)=O)ccc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
LMNA P02545 2/20 0.40
HDAC3 O15379 3/20 0.38
MAPT P10636 3/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
GAA P10253 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 1/20 0.36
SELL P14151 1/20 0.36
SELP P16109 1/20 0.36
SELE P16581 1/20 0.36
HTT P42858 2/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35

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
SCHEMBL9692890 0.92 SMN1; SMN2 (0.41) POLBLMNAHDAC3MAPTHPGD
SCHEMBL9502457 0.91 SMN1; SMN2 (0.42) POLBLMNAHDAC3MAPTHPGD
SCHEMBL9505690 0.86 L3MBTL1 (0.41) POLBLMNAHDAC3MAPTHPGD
SCHEMBL9502202 0.82 ACAT1 (0.41) POLBHDAC3MAPTHPGDSMN1; SMN2
SCHEMBL9502424 0.81 ACAT1 (0.41) POLBHDAC3MAPTHPGDSMN1; SMN2
SCHEMBL9502289 0.80 ACAT1 (0.59) HDAC3HPGDSMN1; SMN2HTTHDAC1
SCHEMBL9503835 0.79 SMN1; SMN2 (0.41) POLBLMNAHDAC3MAPTHPGD
SCHEMBL9506113 0.78 SMN1; SMN2 (0.41) POLBLMNAHDAC3MAPTHPGD
SCHEMBL9506112 0.78 ACAT1 (0.39) HDAC3MAPTHPGDSMN1; SMN2L3MBTL1
SCHEMBL9692556 0.77 HDAC3 (0.43) POLBLMNAHDAC3MAPTHPGD

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-0543865-A1 BENZAMIDE DERIVATIVES RHONE-POULENC RORER LIMITED (GB) 1993-06-02 EP disclosed
WO-1992003412-A2 BENZAMIDE DERIVATIVES RHONE-POULENC RORER LIMITED (GB) 1992-03-05 WO disclosed