SCHEMBL8735148

SCHEMBL8735148

O=C(c1ccc(Sc2ccc([S+](c3ccc(F)cc3)c3ccc(F)cc3)cc2)c(F)c1)c1ccc(O)cc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GAA P10253 2/20 0.40
USP2 O75604 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
IGFBP3 P17936 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
NPC1 O15118 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
KDM4E B2RXH2 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
SCHEMBL8735145 0.87 KCNQ3 (0.45) KCNQ3KCNQ2IGFBP3SMN1; SMN2ALDH1A1
SCHEMBL8734235 0.84 HSP90AA1 (0.37) KCNQ3KCNQ2MEN1KMT2AGAA
SCHEMBL8736812 0.80 KCNQ3 (0.45) KCNQ3KCNQ2USP2IGFBP3SMN1; SMN2
SCHEMBL8736859 0.79 IGFBP3 (0.42) KCNQ3KCNQ2MEN1KMT2AIGFBP3
SCHEMBL8735608 0.79 BLM (0.46) KCNQ3KCNQ2MEN1KMT2AIGFBP3
SCHEMBL8735142 0.79 RAB9A (0.43) KCNQ3KCNQ2MEN1KMT2AIGFBP3
SCHEMBL8735151 0.78 IGFBP3 (0.39) KCNQ3KCNQ2MEN1KMT2AIGFBP3
SCHEMBL30043102 0.77 KCNQ3 (0.43) KCNQ3KCNQ2USP2IGFBP3SMN1; SMN2
SCHEMBL8734187 0.77 KMT2A (0.39) KCNQ3KCNQ2MEN1KMT2AGAA
SCHEMBL8736805 0.76 HTT (0.47) KCNQ3KCNQ2SMN1; SMN2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120130117-A1 AROMATIC SULFONIUM SALT COMPOUND ADEKA CORPORATION (JP) 2012-05-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120130117-A1 AROMATIC SULFONIUM SALT COMPOUND SLC6A19, ARSA, PAH KCNQ3 1318/4885KCNQ2 1367/4885MEN1 3308/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.