SCHEMBL3203243

SCHEMBL3203243

Cc1cc(C)cc([S+](c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
ACHE P22303 2/20 0.37
TPMT P51580 1/20 0.35
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
SELE P16581 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
C1S P09871 1/20 0.33
PRSS3 P35030 1/20 0.33
RAPGEF4 Q8WZA2 2/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSP90AA1 P07900 1/20 0.31
CCR6 P51684 1/20 0.31

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
SCHEMBL3193994 0.84 ACHE (0.41) ALDH1A1TSHRACHETPMTTDP1
SCHEMBL134576 0.84 ACHE (0.41) ALDH1A1TSHRACHETPMTTDP1
SCHEMBL26115 0.76
SCHEMBL341533 0.76 ALDH1A1 (0.67) ALDH1A1TSHRACHETPMTSELL
SCHEMBL11390703 0.73 ALDH1A1 (0.40) ALDH1A1TSHRACHETPMTSELL
SCHEMBL25403949 0.71 ALDH1A1 (0.61) ALDH1A1TSHRACHETPMTSELL
SCHEMBL25401798 0.71 ALDH1A1 (0.61) ALDH1A1TSHRACHETPMTSELL
SCHEMBL23202758 0.71 ALDH1A1 (0.61) ALDH1A1TSHRACHETPMTSELL
Hydrochloric Acid SCHEMBL2443762 0.71 ALDH1A1 (0.61) ALDH1A1TSHRACHETPMTSELL
SCHEMBL23202757 0.71 ALDH1A1 (0.61) ALDH1A1TSHRACHETPMTSELL

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