SCHEMBL5807228

SCHEMBL5807228

CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)CS

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.70
GAA P10253 1/20 0.70
ALDH1A1 P00352 6/20 0.67
HPGD P15428 2/20 0.67
MAPT P10636 2/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
PTPN1 P18031 2/20 0.66
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
KDM4E B2RXH2 1/20 0.62
THRB P10828 1/20 0.61
POLB P06746 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MAPK8 P45983 3/20 0.55

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
SCHEMBL5807226 0.90 LMNA (0.71) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL5804336 0.87 POLB (0.74) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL5804285 0.86 MAPT (0.72) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL8289363 0.85 POLB (0.71) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL3931523 0.83 PTPN1 (0.78) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL5804332 0.78 POLB (0.74) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL14478927 0.78 TP53 (0.65) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL689196 0.77 PRKCZ (0.78) GAAALDH1A1HPGDMAPTKMT2A
SCHEMBL23579845 0.77 POLB (0.72) LMNAGAAALDH1A1HPGDMAPT
SCHEMBL5919026 0.76 PRKCZ (0.62) LMNAGAAALDH1A1MAPTPTPN1

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-2006093518-A2 THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS APATH, LLC (US) 2006-09-08 WO disclosed