SCHEMBL5409949

SCHEMBL5409949

CCc1ccc([I+]c2ccc(CC)cc2)cc1.O=S(=O)([O-])c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.41
CA1 P00915 6/20 0.35
ALDH1A1 P00352 2/20 0.35
UCHL1 P09936 1/20 0.34
HDAC6 Q9UBN7 3/20 0.33
HDAC3 O15379 2/20 0.33
HDAC11 Q96DB2 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
HSD11B1 P28845 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 2/20 0.33
METAP2 P50579 1/20 0.32

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
SCHEMBL5411399 0.88 CA2 (0.44) CA2CA1ALDH1A1L3MBTL1KMT2A
Toliodium SCHEMBL2902228 0.81 TLR9 (0.38) CA2CA1ALDH1A1HDAC6HDAC11
SCHEMBL5408516 0.81 CA2 (0.41) CA2CA1ALDH1A1UCHL1HDAC6
SCHEMBL5413750 0.81 CA2 (0.44) CA2CA1ALDH1A1UCHL1L3MBTL1
SCHEMBL4389991 0.79 NPC1 (0.34) HDAC6HDAC11HDAC8LMNA
SCHEMBL1800652 0.78 ALDH1A1 (0.38) CA2CA1ALDH1A1KMT2ALMNA
SCHEMBL503663 0.78 CA1 (0.38) CA2CA1HDAC6HDAC11HDAC8
SCHEMBL503800 0.77 ALDH1A1 (0.41) CA2CA1ALDH1A1HDAC6HDAC11
SCHEMBL5408665 0.77 MCOLN3 (0.38) CA2CA1ALDH1A1L3MBTL1LMNA
SCHEMBL5422313 0.77 KAT6A (0.39) CA2ALDH1A1HSD11B1KMT2A

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