SCHEMBL7722993

SCHEMBL7722993

O=C(Nc1ccccc1SS)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.68
TDP1 Q9NUW8 3/20 0.68
TP53 P04637 3/20 0.61
MDM4 O15151 2/20 0.61
MDM2 Q00987 1/20 0.60
HPGD P15428 2/20 0.56
HDAC3 O15379 1/20 0.56
MAPK1 P28482 1/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC2 Q92769 1/20 0.56
POLB P06746 1/20 0.56
KMT2A Q03164 6/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.55
ALDH1A1 P00352 4/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
GLA P06280 1/20 0.55
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
CYP1A2 P05177 1/20 0.53

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
SCHEMBL6445769 0.88 TDP1 (0.58) MAPTTDP1TP53MDM4MDM2
SCHEMBL1023209 0.85 MAPT (0.83) MAPTTDP1TP53MDM4MDM2
SCHEMBL34933 0.85 TDP1 (0.72) MAPTTDP1TP53MDM4MDM2
SCHEMBL28189189 0.84 KMT2A (0.76) MAPTTDP1TP53MDM4MDM2
SCHEMBL28896841 0.81 TDP1 (1.00) MAPTTDP1TP53MDM4MDM2
SCHEMBL1110180 0.80 MDM4 (0.73) MAPTTDP1TP53MDM4HPGD
SCHEMBL28277559 0.78 MAPT (0.62) MAPTTDP1TP53MDM4MDM2
SCHEMBL1534076 0.78 ALDH1A1 (0.55) TP53MDM4MDM2HPGDMAPK1
SCHEMBL1490917 0.77 MDM4 (0.63) MAPTTDP1TP53MDM4MDM2
SCHEMBL6445765 0.76 TDP1 (0.59) MAPTTDP1TP53MDM4MDM2

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-20020065151-A1 Multi-piece solid golf ball SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2002-05-30 US disclosed