SCHEMBL6455231

SCHEMBL6455231

CC(=O)Nc1ccc(-c2csc(C(=O)O)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALAD P13716 2/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
KMT2A Q03164 9/20 0.46
MAPT P10636 6/20 0.46
MEN1 O00255 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 3/20 0.46
RXFP1 Q9HBX9 2/20 0.46
NAPRT Q6XQN6 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CYP2C19 P33261 1/20 0.46
SIRT5 Q9NXA8 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
GAA P10253 2/20 0.45
NPC1 O15118 1/20 0.45

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
SCHEMBL6875236 0.88 SMN1; SMN2 (0.56) ALADHTTSMN1; SMN2L3MBTL1KMT2A
SCHEMBL28490756 0.80 DAO (0.52) ALADHTTSMN1; SMN2L3MBTL1KMT2A
SCHEMBL6142371 0.79 ALAD (0.65) ALADSMN1; SMN2L3MBTL1KMT2AMAPT
SCHEMBL1800477 0.78 ALAD (0.69) ALADSMN1; SMN2ALDH1A1KDM4EGAA
Hydrochloric Acid SCHEMBL6368905 0.78 ALAD (0.63) ALADSMN1; SMN2L3MBTL1KMT2AMAPT
SCHEMBL3818831 0.77 SMN1; SMN2 (1.00) HTTSMN1; SMN2L3MBTL1KMT2AMAPT
SCHEMBL6450949 0.76 ALAD (0.71) ALADKMT2AMAPTMEN1ALDH1A1
SCHEMBL505511 0.76 ALAD (0.70) ALADKMT2AMEN1NPC1RAB9A
SCHEMBL9762638 0.75 SMN1; SMN2 (0.86) HTTSMN1; SMN2L3MBTL1KMT2AMAPT
SCHEMBL4149291 0.75 ALAD (0.59) ALADHTTSMN1; SMN2MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534700-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2005-06-01 EP claimed
WO-2004018448-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2004-03-04 WO claimed
EP-1394159-A1 New thiophene derivatives, process for their preparation and pharmaceutical compositions containing them Warner-Lambert Company LLC (US) 2004-03-03 EP claimed
EP-1534700-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2005-06-01 EP disclosed
WO-2004018448-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2004-03-04 WO disclosed
EP-1394159-A1 New thiophene derivatives, process for their preparation and pharmaceutical compositions containing them Warner-Lambert Company LLC (US) 2004-03-03 EP disclosed