SCHEMBL7430766

SCHEMBL7430766

N=C(NO)c1nc(-c2ccc(O)cc2)cs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.53
MKNK1 Q9BUB5 1/20 0.53
MKNK2 Q9HBH9 1/20 0.53
MAPT P10636 6/20 0.50
AMY1A P0DUB6 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ALOX15 P16050 2/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
THRB P10828 1/20 0.50
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 3/20 0.46

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
SCHEMBL7438464 0.87 MAPT (0.54) LTA4HMAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL7433530 0.86 RAB9A (0.49) LTA4HMAPTAMY1ASMN1; SMN2ALDH1A1
SCHEMBL7430029 0.86 ALDH1A1 (0.52) MAPTSMN1; SMN2ALDH1A1TDP1LMNA
SCHEMBL7438575 0.86 RAB9A (0.50) LTA4HMAPTAMY1ASMN1; SMN2ALDH1A1
SCHEMBL7441613 0.85 MAPT (0.50) MAPTAMY1ASMN1; SMN2ALDH1A1ALOX15
SCHEMBL7444812 0.82 HDAC1 (0.49) LTA4HMAPTALDH1A1LMNAHTT
SCHEMBL7435763 0.82 MAPT (0.55) MAPTSMN1; SMN2ALDH1A1GAAMEN1
SCHEMBL7436552 0.79 PTGS2 (0.45) MAPTSMN1; SMN2ALDH1A1USP2LMNA
SCHEMBL7428965 0.79 RAB9A (0.55) MAPTSMN1; SMN2ALDH1A1LMNAGAA
SCHEMBL7434491 0.79 ABL1 (0.51) MAPTLMNAGAATHRBNPSR1

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