SCHEMBL7429092

SCHEMBL7429092

CSc1cccc(-c2csc(C(N)=NO)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFTR P13569 8/20 0.47
ATP4A P20648 7/20 0.42
ATP4B P51164 7/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
HIF1A Q16665 1/20 0.41
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39
PRSS1 P07477 1/20 0.39
C1S P09871 1/20 0.39
TSHR P16473 1/20 0.39
RECQL P46063 1/20 0.39
IDO1 P14902 1/20 0.38

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
SCHEMBL7434052 0.84 CYP3A4 (0.52) CFTRATP4AATP4BPLGPLAU
SCHEMBL7437056 0.83 ATP4A (0.61) ATP4AATP4BALDH1A1LMNAMAPT
SCHEMBL7444038 0.81 ALDH1A1 (0.51) ATP4AATP4BALDH1A1LMNAMAPT
SCHEMBL7429814 0.80 KDM4E (0.60) ATP4AATP4BALDH1A1LMNAMAPT
SCHEMBL7437724 0.80 ATP4A (0.61) CFTRATP4AATP4BALDH1A1LMNA
SCHEMBL7435903 0.80 ALDH1A1 (0.60) ATP4AATP4BALDH1A1LMNAMAPT
SCHEMBL7441627 0.79 ALDH1A1 (0.61) ATP4AATP4BALDH1A1LMNAMAPT
SCHEMBL7426086 0.77 ALDH1A1 (0.51) CFTRALDH1A1MAPT
SCHEMBL7429088 0.77 CFTR (0.47) CFTRALDH1A1MAPTPLGPLAU
SCHEMBL7436562 0.76 PTGS2 (0.45) ATP4AATP4BALDH1A1LMNAMAPT

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