SCHEMBL3194693

SCHEMBL3194693

CCc1cc(CC)c(S(OS(=O)(=O)c2ccc(F)cc2F)(c2ccccc2)c2ccccc2)c(CC)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.40
HTR2C P28335 5/20 0.40
GAA P10253 1/20 0.37
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
KCNH2 Q12809 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
DRD2 P14416 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR6 P50406 3/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
ABCC9 O60706 1/20 0.31
ABCC8 Q09428 1/20 0.31
KCNJ11 Q14654 1/20 0.31
KCNJ8 Q15842 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
SCHEMBL3193859 0.87 HTR2A (0.45) HTR2AHTR2CGAATP53THRB
SCHEMBL3193630 0.85 F2 (0.39) HTR2AHTR2CTP53THRBTSHR
SCHEMBL3190409 0.83 LMNA (0.34) HTR2AHTR2CMAPK1SMN1; SMN2ALDH1A1
SCHEMBL2537987 0.82 HTR2A (0.41) HTR2AHTR2CGAAKCNH2ALDH1A1
SCHEMBL3188845 0.82 CA1 (0.35) HTR2AHTR2CTP53THRBMAPK1
SCHEMBL3189928 0.81 TSHR (0.37) HTR2AHTR2CGAATSHRMAPK1
SCHEMBL548240 0.80 FFAR4 (0.38) HTR2AHTR2CGAATSHRMAPK1
SCHEMBL3197638 0.78 CYP3A4 (0.37) TP53TSHRALDH1A1PTGDR2
SCHEMBL2954165 0.78 HTR2A (0.39) HTR2AHTR2CGAATSHRMAPK1
SCHEMBL3200901 0.78 ABCC9 (0.34) HTR2AHTR2CGAATP53KCNH2

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 6 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