SCHEMBL7653528

SCHEMBL7653528

CCCCCSC1=Cc2cccc3cccc1c23

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 12/20 0.51
P4HB P07237 1/20 0.48
S100A4 P26447 1/20 0.46
G6PD P11413 1/20 0.40
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
TLR8 Q9NR97 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL29270246 0.74 SOAT1 (0.43) SOAT1P4HBS100A4G6PDTDP1
SCHEMBL29270291 0.74 SOAT1 (0.43) SOAT1P4HBS100A4G6PDTDP1
SCHEMBL29270293 0.74 SOAT1 (0.43) SOAT1P4HBS100A4G6PDTDP1
SCHEMBL29270265 0.74 SOAT1 (0.43) SOAT1P4HBS100A4G6PDTDP1
SCHEMBL7617299 0.73 MEN1 (0.47) SOAT1S100A4MEN1MAPTMAPK1
SCHEMBL1024206 0.73 PTPN1 (0.50) S100A4MEN1MAPTMAPK1KMT2A
SCHEMBL23698912 0.72 TDP1 (0.44) S100A4MEN1MAPTMAPK1KMT2A
SCHEMBL4226508 0.72 PTPN1 (0.53) MEN1MAPTMAPK1KMT2ATDP1
SCHEMBL27778148 0.71 PTPN1 (0.44) S100A4MEN1MAPTMAPK1KMT2A
SCHEMBL4848419 0.71 SOAT1 (0.78) SOAT1P4HBS100A4G6PDALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6458506-B2 GENERATING ANTHRACENE ACID UPON EXPOSURE TO ACTIVATING RADIATION SHIPLEY COMPANY, LLC 2002-10-01 US disclosed
US-20020001770-A1 PHOTOACID GENERATORS AND PHOTORESISTS COMPRISING SAME SHIPLEY COMPANY, L.L.C. 2002-01-03 US disclosed
WO-2000010056-A9 PHOTOACID GENERATORS AND PHOTORESISTS COMPRISING SAME SHIPLEY CO LLC (US) 2000-06-08 WO disclosed
WO-2000010056-A1 PHOTOACID GENERATORS AND PHOTORESISTS COMPRISING SAME SHIPLEY COMPANY, L.L.C. (US) 2000-02-24 WO disclosed