SCHEMBL9410488

SCHEMBL9410488

CCSc1ccccc1SSc1ccccc1SCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 2/20 0.41
NPSR1 Q6W5P4 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CETP P11597 2/20 0.39
S100A4 P26447 2/20 0.38
MAP2K7 O14733 1/20 0.38
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
ALDH1A1 P00352 3/20 0.37
RXFP1 Q9HBX9 2/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
ADRA2A P08913 2/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37

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
SCHEMBL9793625 0.92 S100A4 (0.41) NPSR1MAPTMEN1KMT2AS100A4
SCHEMBL10144166 0.82 ALDH1A1 (0.47) NPSR1MAPTKMT2AS100A4MAP2K7
SCHEMBL30958568 0.79 NPC1 (0.47) NPSR1MAPTS100A4MAP2K7CDC25A
SCHEMBL5609829 0.77 S100A4 (0.41) NPSR1MAPTS100A4MAP2K7CDC25A
SCHEMBL29565819 0.77 MEN1 (0.58) APOBEC3GNPSR1MAPTMEN1KMT2A
SCHEMBL2857496 0.77 MEN1 (0.58) APOBEC3GNPSR1MAPTMEN1KMT2A
SCHEMBL3883291 0.77 MCHR1 (0.47) NPSR1MAPTS100A4MAP2K7CDC25A
SCHEMBL12968375 0.77 AR (0.35) NPSR1MAPTMEN1KMT2AS100A4
SCHEMBL25018238 0.75 S100A4 (0.39) NPSR1MAPTS100A4MAP2K7CDC25A
SCHEMBL14507031 0.75 GABRA1 (0.41) APOBEC3GNPSR1MAPTS100A4MAP2K7

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-0594857-A1 METHANEDIPHOSPHONIC ACID DERIVATIVE, PRODUCTION THEREOF AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1994-05-04 EP disclosed