SCHEMBL9459291

SCHEMBL9459291

O=C(O)NC(=O)SCc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
IDO1 P14902 3/20 0.50
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
ALDH1A1 P00352 3/20 0.42
HPGD P15428 3/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
PTPRG P23470 1/20 0.42
GAA P10253 1/20 0.41
HTT P42858 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 3/20 0.40
MAPT P10636 2/20 0.40
ALOX12 P18054 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL11690276 0.81 SMN1; SMN2 (0.49) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL8345822 0.79 TDP1 (0.62) TDP1L3MBTL1IDO1KMT2AMEN1
Hydrochloric Acid SCHEMBL11842725 0.77 TDP1 (0.61) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL22767269 0.76 TDP1 (0.65) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL11235402 0.75 MAPT (0.41) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL28398594 0.73 MEN1 (0.46) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL14611678 0.73 IDO1 (0.57) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL6689595 0.73 IDO1 (0.68) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL10409192 0.73 IDO1 (0.52) TDP1L3MBTL1IDO1KMT2AMEN1
SCHEMBL22524929 0.72 TDP1 (0.51) TDP1L3MBTL1KMT2AMEN1GAA

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
US-5189058-A Anticholesterol agents WARNER-LAMBERT COMPANY (US) 1993-02-23 US claimed