SCHEMBL3191983

SCHEMBL3191983

Cc1ccc(O)cc1[S+](c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.44
ACHE P22303 2/20 0.38
ESR1 P03372 3/20 0.35
ALOX5 P09917 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
RECQL P46063 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 1/20 0.35
CYTH2 Q99418 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL3191952 0.85 ESR2 (0.48) ESR2ACHEESR1ALOX5CYP3A4
SCHEMBL3181363 0.80 TDP1 (0.37) ACHECYP3A4TSHRCYP1A2CYP2C19
SCHEMBL3204433 0.80 ALOX5 (0.42) ESR2ESR1ALOX5CYP3A4CYP1A2
Bromide SCHEMBL11360078 0.78 TDP1 (0.35) ACHECYP3A4TSHRCYP1A2CYP2C19
SCHEMBL3193140 0.78 ALOX5 (0.48) ESR2ESR1ALOX5CYP3A4TSHR
SCHEMBL3202166 0.77 MAOB (0.44) ESR2ESR1CYP3A4TSHRRECQL
SCHEMBL3204685 0.76 TDP1 (0.37) ACHECYP3A4TSHRCYP1A2CYP2C19
SCHEMBL423504 0.74 TSHR (0.43) ACHEESR1CYP3A4TSHRCYP1A2
SCHEMBL3193543 0.74 GAA (0.44) ACHECYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL3192396 0.73 MAOB (0.48) ESR2ESR1CYP3A4TSHRKDM4E

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