SCHEMBL11070528

SCHEMBL11070528

Cc1cc(Cl)ccc1NC(=S)Nc1cccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.61
KMT2A Q03164 5/20 0.61
MEN1 O00255 3/20 0.61
RAB9A P51151 3/20 0.60
NPC1 O15118 2/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
THRB P10828 1/20 0.59
POLB P06746 1/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 2/20 0.56
GAA P10253 3/20 0.55
KDM4E B2RXH2 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
SCHEMBL11054345 0.86 GRIK1 (0.66) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL1275812 0.80 KMT2A (0.72) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL11072641 0.80 KMT2A (0.73) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL10514431 0.78 RAB9A (0.69) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL24004522 0.77 GRIK1 (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL11504808 0.76 NOX1 (0.77) NOX1RAB9ANPC1SMN1; SMN2THRB
SCHEMBL16566574 0.75 ALDH1A1 (0.65) KMT2AMEN1ALDH1A1MAPT
SCHEMBL10488934 0.74 MAPT (0.76) NOX1RAB9ANPC1SMN1; SMN2THRB
SCHEMBL8491865 0.74 RAB9A (1.00) NOX1KMT2AMEN1RAB9ANPC1
SCHEMBL10393959 0.74 KMT2A (0.64) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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-4461821-A Photoconductive compositions and electrophotographic photosensitive materials comprising an organic photoconductor and a thiourea compound FUJI PHOTO FILM CO., LTD. (JP) 1984-07-24 US disclosed