SCHEMBL8757318

SCHEMBL8757318

CC(=O)Oc1ccc([S+](C)Cc2ccccc2)cc1.CCCC[B-](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.42
▸ ELANE P08246 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ PTGS2 P35354 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ BACE1 P56817 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL8757303 0.89 CNR2 (0.34) GAANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL156358 0.84 ELANE (0.51) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL9241421 0.82 GAA (0.47) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL30217832 0.80 GAA (0.47) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL30217900 0.80 GAA (0.47) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL30243179 0.76 GAA (0.41) GAAELANENPC1RAB9ASMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL4165790 0.76 GAA (0.41) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL10440732 0.74 KMT2A (0.39) GAAELANENPC1RAB9ASMN1; SMN2
SCHEMBL8757126 0.73 DNM1 (0.37) SMN1; SMN2ALDH1A1HTT
SCHEMBL13220642 0.72 RAB9A (0.43) GAANPC1RAB9ASMN1; SMN2MAPT

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
EP-0555058-B1 (Oxo)sulfonium complex, polymerizable composition containing the complex, and method of polymerizing composition TOYO INK MFG CO (JP) 1997-05-07 — — EP disclosed
US-5500453-A INITIATOR FOR PHOTOSENSITIVE FREE RADICAL CURING/ POLYMERIZATION OF UNSATURATED COMPOUNDS TOYO INK MANUFACTURING CO., LTD. (JP) 1996-03-19 — — US disclosed
EP-0555058-A1 (Oxo)sulfonium complex, polymerizable composition containing the complex, and method of polymerizing composition TOYO INK MANUFACTURING CO., LTD. (JP) 1993-08-11 — — EP disclosed
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