SCHEMBL11317515

SCHEMBL11317515

Nc1ccc(NNC(=S)Nc2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.76
KMT2A Q03164 4/20 0.76
RAB9A P51151 4/20 0.76
MEN1 O00255 3/20 0.76
GAA P10253 10/20 0.62
NPC1 O15118 4/20 0.62
NOX1 Q9Y5S8 3/20 0.62
ALDH1A1 P00352 10/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
LMNA P02545 3/20 0.60
TDP1 Q9NUW8 2/20 0.60
ALOX12 P18054 2/20 0.60
HTT P42858 2/20 0.60
NPSR1 Q6W5P4 1/20 0.60
MAOA P21397 2/20 0.56
MAOB P27338 2/20 0.56
CYP3A4 P08684 2/20 0.55
TAS2R38 P59533 1/20 0.55
HSD17B10 Q99714 1/20 0.55
EGFR P00533 1/20 0.55

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
SCHEMBL2231449 0.89 GAA (0.78) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL5077463 0.87 KMT2A (1.00) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL11309040 0.85 GAA (0.78) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL11318231 0.85 GAA (0.78) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL11309583 0.78 GAA (0.60) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL2885482 0.78 GAA (0.67) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL8956322 0.76 ALDH1A1 (0.94) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL9226811 0.76 MAPT (0.71) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL11315917 0.76 ALDH1A1 (1.00) MAPTKMT2ARAB9AMEN1GAA
SCHEMBL10348335 0.75 GAA (0.63) MAPTKMT2ARAB9AMEN1GAA

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
US-4264710-A AN ETHYLENICALLY UNSATURATED COMPOUND, AND A PHOTOPOLYMERIZATION INIATOR FUJI PHOTO FILM CO., LTD. (JP) 1981-04-28 US claimed