SCHEMBL9370348

SCHEMBL9370348

Nc1ccc(-c2csc(NC(=O)N3CCCCC3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
ROCK1 Q13464 7/20 0.59
ROCK2 O75116 3/20 0.59
CNR2 P34972 1/20 0.54
NPC1 O15118 2/20 0.53
FAAH O00519 1/20 0.52
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
PPARG P37231 2/20 0.49
KMT2A Q03164 2/20 0.49
NCOA2 Q15596 2/20 0.49
NCOA1 Q15788 2/20 0.49
NCOA3 Q9Y6Q9 2/20 0.49
NPY5R Q15761 1/20 0.49
GAA P10253 1/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC2 Q92769 2/20 0.49

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
SCHEMBL9375272 0.89 LMNA (0.60) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9370393 0.89 ROCK1 (0.61) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9374540 0.88 LMNA (0.61) LMNAROCK1ROCK2CNR2FAAH
SCHEMBL9376878 0.88 LMNA (0.79) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9370967 0.88 ABL1 (0.62) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9370971 0.88 LMNA (0.61) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9371263 0.87 NPC1 (0.68) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9371260 0.86 HDAC3 (0.56) LMNAROCK1ROCK2CNR2NPC1
SCHEMBL9370411 0.84 ACHE (0.67) LMNAROCK1ROCK2NPC1KDM4E
SCHEMBL9370685 0.84 GSTO1 (0.61) LMNAROCK1ROCK2CNR2NPC1

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
EP-0589985-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1994-04-06 EP disclosed
WO-1993000342-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-01-07 WO disclosed
EP-0519449-A1 2-Amino-4-aryl thiazoles with antiasthmatic and antiinflammatory activities on the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-12-23 EP disclosed