SCHEMBL5403705

SCHEMBL5403705

CCCc1ccc([S+](c2ccc(CCC)cc2)c2ccc(CCC)cc2)cc1.O=S(=O)([O-])c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.44
CA1 P00915 5/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
FFAR4 Q5NUL3 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PLK1 P53350 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
THRB P10828 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FFAR1 O14842 1/20 0.34
GPR183 P32249 1/20 0.33
CNR2 P34972 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
SCHEMBL5403721 0.94 CA2 (0.40) CA2CA1L3MBTL1ALDH1A1KMT2A
SCHEMBL5408516 0.88 CA2 (0.41) CA2CA1L3MBTL1ALDH1A1LMNA
SCHEMBL5419102 0.86 CA2 (0.42) CA2CA1FFAR4SMN1; SMN2ALDH1A1
SCHEMBL5408941 0.82 CA2 (0.37) CA2CA1L3MBTL1ALDH1A1LMNA
SCHEMBL5411399 0.82 CA2 (0.44) CA2CA1L3MBTL1FFAR4SMN1; SMN2
SCHEMBL6280204 0.79 CA2 (0.36) CA2CA1FFAR4LMNACNR2
SCHEMBL5408495 0.79 GAA (0.38) CA2CA1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL3204378 0.78 KAT6A (0.33) CA2CA1CNR2
SCHEMBL6280199 0.77 NR1I2 (0.35) CA2SMN1; SMN2MEN1KMT2A
SCHEMBL5421312 0.76 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312014-B2 Poly(p-hydroxystyrene/styrene/alkyl acrylate) terpolymer derivative and acid generator comprising triphenylsulfonium benzenesulfonate derivative; forming positive pattern using transcription technology in high vacuum with irradiated energy such as electron beam, extreme ultraviolet ray and X-ray WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2007-12-25 US disclosed
US-20040170918-A1 Poly(p-hydroxystyrene/styrene/alkyl acrylate) terpolymer derivative and acid generator comprising triphenylsulfonium benzenesulfonate derivative; forming positive pattern using transcription technology in high vacuum with irradiated energy such as electron beam, extreme ultraviolet ray and X-ray WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2004-09-02 US disclosed
EP-1406123-A1 RESIST COMPOSITIONS Wako Pure Chemical Industries, Ltd. (JP) 2004-04-07 EP disclosed