SCHEMBL13864441

SCHEMBL13864441

c1ccc2c(c1)CSc1ccccc1CS2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 1/20 0.47
ALOX12 P18054 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
RYR2 Q92736 2/20 0.46
ACHE P22303 1/20 0.46
GAA P10253 2/20 0.46
HSD17B3 P37058 2/20 0.44
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
POLB P06746 2/20 0.40
CHRM2 P08172 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2D6 P10635 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD2 P14416 1/20 0.40
ADRA2B P18089 1/20 0.40

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
SCHEMBL15761043 1.00
Phosphoric Acid SCHEMBL8660571 0.86 ALDH1A1 (0.46) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL11065212 0.85 ALDH1A1 (0.44) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL10253628 0.85 HSD17B3 (0.43) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL3772410 0.85 HSD17B3 (0.43) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL1120940 0.79 RYR2 (0.41) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL216973 0.79 ACHE (0.56) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL4097670 0.79 ALDH1A1 (0.40) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL4857897 0.78 RYR2 (0.48) ALDH1A1MAPTHPGDALOX12TDP1
SCHEMBL13950596 0.76 ALDH1A1 (0.38) ALDH1A1MAPTHPGDALOX12TDP1

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
US-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed
US-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed