SCHEMBL9853537

SCHEMBL9853537

CCc1ccc[c]c1NC(N)=S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
TP53 P04637 1/20 0.36
TYR P14679 1/20 0.36
TSHR P16473 1/20 0.36
TAS2R38 P59533 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CACNA1C Q13936 1/20 0.35
SCN5A Q14524 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34

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
SCHEMBL11673816 0.80 GABRA1 (0.37) ALDH1A1MAPTGAATP53TYR
SCHEMBL6611507 0.74 ALDH1A1 (0.34) ALDH1A1MAPTGRIN2DGRIN3BGRIN1
SCHEMBL6967624 0.74 SIGMAR1 (0.38) ALDH1A1MAPTGAAGRIN2DGRIN3B
SCHEMBL11543470 0.73 CACNA1C (0.54) ALDH1A1MAPTGAATSHRCACNA1C
SCHEMBL3367919 0.72 BID (0.35)
SCHEMBL5527102 0.72 MAPT (0.69) ALDH1A1MAPTGAAGRIN2DGRIN3B
SCHEMBL7428707 0.70 GABRA1 (0.38) ALDH1A1MAPTGAAGRIN2DGRIN3B
SCHEMBL10969933 0.70 ALDH1A1 (0.44) ALDH1A1GAASIGMAR1TP53TYR
SCHEMBL5520049 0.68 ALDH1A1 (0.58) ALDH1A1MAPTHSD17B10KMT2AHTT
SCHEMBL15259641 0.68 ALDH1A1 (0.50) ALDH1A1MAPTGAAGRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409665-A1 Silver halide photographic material provided with antistatic coating KONICA CORPORATION (JP) 1991-01-23 EP disclosed