SCHEMBL11285356

SCHEMBL11285356

O=CCC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)COc3ccccc3)C2SC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.50
PTGS1 P23219 1/20 0.46
TDP1 Q9NUW8 5/20 0.44
MAPT P10636 5/20 0.43
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 4/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
CYP3A4 P08684 3/20 0.43
MEN1 O00255 2/20 0.43
SLC15A2 Q16348 2/20 0.43
MAPK1 P28482 2/20 0.43
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
DUSP3 P51452 1/20 0.43
PTPN5 P54829 1/20 0.43
PTPN11 Q06124 1/20 0.43

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
SCHEMBL9476836 0.93 CTDSP1 (0.51) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9476827 0.93 CTDSP1 (0.51) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9140737 0.91 CTDSP1 (0.54) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9143994 0.91 L3MBTL1 (0.56) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL11015752 0.91 CTDSP1 (0.54) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9143991 0.91 L3MBTL1 (0.56) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9140732 0.91 CTDSP1 (0.54) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9477095 0.90 CTDSP1 (0.55) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL9477097 0.90 CTDSP1 (0.55) CTDSP1L3MBTL1PTGS1TDP1MAPT
SCHEMBL11674205 0.90 CTDSP1 (0.53) CTDSP1L3MBTL1PTGS1TDP1MAPT

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
US-4365062-A BACTERICIDAL ANTIBIOTICS RHONE-POULENC INDUSTRIES (FR) 1982-12-21 US claimed
US-4365062-A BACTERICIDAL ANTIBIOTICS RHONE-POULENC INDUSTRIES (FR) 1982-12-21 US disclosed