SCHEMBL7436562

SCHEMBL7436562

Cc1ccc(-c2csc(C(N)=NO)n2)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.45
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
GFER P55789 2/20 0.40
ATP4A P20648 5/20 0.40
ATP4B P51164 5/20 0.40
LMNA P02545 4/20 0.40
HTT P42858 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40
ESR2 Q92731 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL7433535 0.84 MAPT (0.57) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL7426301 0.82 MEN1 (0.48) PTGS2KMT2AMEN1NPC1RAB9A
SCHEMBL7437056 0.82 ATP4A (0.61) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL1815975 0.81 MEN1 (0.53) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL8328119 0.81 MEN1 (0.53) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL7428970 0.80 NPC1 (0.59) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL7434501 0.80 ALOX5 (0.50) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL7430796 0.79 LTA4H (0.57) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL7438579 0.78 MAPT (0.51) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL7430035 0.78 ALDH1A1 (0.63) KMT2AMEN1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506194-B1 4-aryl-thiazole or imidazole derivatives AKZO NOBEL NV (NL) 1996-08-21 EP disclosed
US-5462959-A 4-aryl-imidazole derivatives AKZO N.V. (NL) 1995-10-31 US disclosed
US-5254575-A 4-aryl-thiazole derivatives AKZO N.V. (NL) 1993-10-19 US disclosed
EP-0506194-A1 4-aryl-thiazole or imidazole derivatives Akzo Nobel N.V. (NL) 1992-09-30 EP disclosed