SCHEMBL8735608

SCHEMBL8735608

Cc1ccc(C(=O)c2ccc(Sc3ccc([S+](c4ccc(F)cc4)c4ccc(F)cc4)cc3)c(F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.46
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
ALDH1A1 P00352 7/20 0.43
HPGD P15428 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 5/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
IGFBP3 P17936 1/20 0.38
MAPK14 Q16539 6/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38

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
SCHEMBL8736812 0.89 KCNQ3 (0.45) KCNQ3KCNQ2ALDH1A1HPGDKDM4E
SCHEMBL8735145 0.89 KCNQ3 (0.45) BLMKCNQ3KCNQ2ALDH1A1HPGD
SCHEMBL1792992 0.87 ALDH1A1 (0.48) BLMALDH1A1HPGDKDM4EMAPT
SCHEMBL30043102 0.86 KCNQ3 (0.43) KCNQ3KCNQ2ALDH1A1HPGDKDM4E
SCHEMBL30206697 0.85 BLM (0.42) BLMKCNQ3KCNQ2ALDH1A1HPGD
SCHEMBL13088088 0.84 IGFBP3 (0.42) KCNQ3KCNQ2ALDH1A1HPGDMAPT
SCHEMBL8736805 0.82 HTT (0.47) BLMKCNQ3KCNQ2ALDH1A1HPGD
SCHEMBL29771050 0.81 ALDH1A1 (0.42) BLMKCNQ3KCNQ2ALDH1A1HPGD
SCHEMBL8736859 0.81 IGFBP3 (0.42) KCNQ3KCNQ2ALDH1A1HPGDMAPT
SCHEMBL8735142 0.81 RAB9A (0.43) KCNQ3KCNQ2ALDH1A1HPGDMAPT

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 BLM 4561/4885KCNQ3 1318/4885KCNQ2 1367/4885

“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.