SCHEMBL1847840

SCHEMBL1847840

NC(=S)Oc1nc2ccccc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
ALDH1A1 P00352 5/20 0.53
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS1 P23219 4/20 0.44
PTGS2 P35354 4/20 0.44
IDO1 P14902 1/20 0.43
UBE2T Q9NPD8 1/20 0.43
ASIC3 Q9UHC3 1/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 2/20 0.42

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
SCHEMBL10719546 0.84 SMN1; SMN2 (0.51) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL10723996 0.83 PTGS1 (0.48) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL6632291 0.83 CYP1A2 (0.54) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL11078345 0.83 SMN1; SMN2 (0.47) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL28950163 0.83 CYP1A2 (0.47) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL6270396 0.80 SMN1; SMN2 (0.51) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL20509384 0.79 SMN1; SMN2 (0.54) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL27957667 0.79 CYP1A2 (0.43) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL11684240 0.79 SMN1; SMN2 (0.56) MAPTALDH1A1GAASMN1; SMN2CYP1A2
SCHEMBL10720726 0.79 SMN1; SMN2 (0.56) ALDH1A1GAASMN1; SMN2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2321309-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS Ranbaxy Laboratories Limited (IN) 2011-05-18 EP disclosed
WO-2009156966-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-12-30 WO disclosed