SCHEMBL7438579

SCHEMBL7438579

NC(=NO)c1nc(-c2ccc(Cl)cc2)cs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
RAB9A P51151 5/20 0.49
NPC1 O15118 5/20 0.49
LTA4H P09960 1/20 0.49
ALOX5 P09917 4/20 0.47
VCP P55072 2/20 0.47
EGFR P00533 1/20 0.47
DEGS1 O15121 1/20 0.47
MAP4K4 O95819 1/20 0.47
CYP3A4 P08684 1/20 0.47
AMY1A P0DUB6 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
MAPKAPK2 P49137 1/20 0.47

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
SCHEMBL7430796 0.86 LTA4H (0.57) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7429957 0.84 ATP4A (0.43) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7433535 0.84 MAPT (0.57) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7438472 0.84 RAB9A (0.59) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7430035 0.84 ALDH1A1 (0.63) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7441627 0.84 ALDH1A1 (0.61) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7434501 0.84 ALOX5 (0.50) MAPTMEN1KMT2AGAARAB9A
SCHEMBL7437724 0.82 ATP4A (0.61) MAPTALDH1A1GAARAB9ANPC1
SCHEMBL2734989 0.81 RAB9A (0.54) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL7444819 0.81 LTA4H (0.51) MAPTALDH1A1MEN1KMT2AL3MBTL1

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