SCHEMBL8922306

SCHEMBL8922306

N#CC(CSP(=O)(O)O)Cc1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.41
ACP3 P15309 1/20 0.37
SLC6A4 P31645 1/20 0.36
MMP2 P08253 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
DPP4 P27487 2/20 0.33
ACACB O00763 1/20 0.33
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
LMNA P02545 1/20 0.33
ALPG P10696 1/20 0.33
HTT P42858 1/20 0.33
MMP1 P03956 1/20 0.33

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
SCHEMBL8921479 0.85 LAP3 (0.44) CTSCACP3CYP1A2
SCHEMBL2575732 0.74 SLC6A4 (0.45) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL11302551 0.71 CTSC (0.47) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL10585788 0.71 CTSC (0.49) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL5908167 0.69 SLC6A4 (0.44) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL8925358 0.69 GGPS1 (0.39) LMNAHTT
SCHEMBL18703964 0.67 SLC6A4 (0.48) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL4657515 0.66 SLC6A4 (0.52) CTSCSLC6A4SLC6A2SLC6A3PPARG
SCHEMBL11357662 0.66 CTSC (0.45) CTSCPPARGPPARALMNAHTT
SCHEMBL11351984 0.64 CTSC (0.43) CTSCPPARGPPARALMNAHTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5644048-A Process for preparing phosphorothioate oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 1997-07-01 US disclosed
WO-1994019363-A1 PROCESS FOR PREPARING PHOSPHOROTHIOATE OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1994-09-01 WO disclosed
US-5210264-A S-(2,4-dichlorobenzyl)-β-cyanoethyl phosphorothioate diester ISIS PHARMACEUTICALS, INC. (US) 1993-05-11 US disclosed