SCHEMBL3204977

SCHEMBL3204977

Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.O=S(=O)([O-])c1ccccc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 10/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HSD11B1 P28845 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CYP2C9 P11712 2/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
SLC22A11 Q9NSA0 1/20 0.39
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
GAA P10253 2/20 0.38
FFAR4 Q5NUL3 2/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
FFAR1 O14842 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
CCNA2 P20248 1/20 0.37

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
SCHEMBL451959 0.91 KMT2A (0.46) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL2898284 0.89 GAA (0.49) SLC22A12KMT2AALDH1A1GAAFFAR4
SCHEMBL452162 0.88 HSD11B1 (0.45) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL29754085 0.88 HSD11B1 (0.45) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL2895718 0.86 KMT2A (0.42) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL3192127 0.85 HSD11B1 (0.38) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL3183361 0.85 GAA (0.51) SLC22A12KMT2AMEN1ALDH1A1GAA
SCHEMBL3202401 0.85 FFAR4 (0.39) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL5445938 0.84 HSD11B1 (0.47) SLC22A12KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL3192045 0.84 SLC22A12 (0.39) SLC22A12KMT2AMEN1HSD11B1ALDH1A1

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