SCHEMBL3206212

SCHEMBL3206212

CCc1ccc([S+](c2ccccc2)c2ccccc2)c(CC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 2/20 0.40
KIF11 P52732 1/20 0.35
TRPA1 O75762 1/20 0.34
METAP2 P50579 1/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
BCL2 P10415 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL3194675 0.86 CYP1A2 (0.41) CYP1A2CYP2A6ALDH1A1NPC1LMNA
SCHEMBL3181999 0.79 CNR1 (0.37) NPC1MAPTRAB9AL3MBTL1KIF11
SCHEMBL4618658 0.79 GABRA1 (0.38) MAPTL3MBTL1TP53NPSR1
SCHEMBL3189010 0.78 TP53 (0.43) CYP1A2CYP2A6ALDH1A1NPC1LMNA
SCHEMBL3189054 0.77 GPR3 (0.39) ALDH1A1NPC1MAPTMAPK1RAB9A
SCHEMBL4773716 0.75 GABRA1 (0.49) LMNATSHR
SCHEMBL246109 0.74 TP53 (0.59) CYP1A2CYP2A6ALDH1A1NPC1LMNA
SCHEMBL3202132 0.71 TP53 (0.48) CYP1A2CYP2A6ALDH1A1NPC1LMNA
SCHEMBL3204227 0.69 GABRA1 (0.38) MAPTL3MBTL1TP53NPSR1
SCHEMBL3182124 0.69 SKP2 (0.38) CYP1A2L3MBTL1KIF11METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed