SCHEMBL8735147

SCHEMBL8735147

O=C(c1ccccc1)c1ccc(Sc2ccc([S+](c3ccc(O)cc3)c3ccc(O)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
MAPT P10636 2/20 0.56
RAB9A P51151 2/20 0.56
HPGD P15428 3/20 0.50
ALDH1A1 P00352 3/20 0.50
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
PKM P14618 1/20 0.48
HTT P42858 1/20 0.48
SRD5A2 P31213 2/20 0.47
CES2 O00748 1/20 0.47
NPC1 O15118 1/20 0.46
NR1H2 P55055 1/20 0.45
L3MBTL1 Q9Y468 4/20 0.43
LIG1 P18858 1/20 0.42
MAPK1 P28482 1/20 0.42
ELANE P08246 1/20 0.41
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL1128326 0.92 ALDH1A1 (0.55) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL7938428 0.90 LMNA (0.68) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL14600281 0.86 LMNA (0.62) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL1790331 0.86 ALDH1A1 (0.53) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL1127927 0.86 ALDH1A1 (0.49) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL1790602 0.86 ALDH1A1 (0.49) LMNAMAPTHPGDALDH1A1SRD5A2
SCHEMBL21679527 0.84 LMNA (0.49) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL13134769 0.84 ALDH1A1 (0.56) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL8736852 0.84 MEN1 (0.43) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL8735142 0.84 RAB9A (0.43) LMNAMEN1KMT2AMAPTRAB9A

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 LMNA 4190/4885MEN1 3308/4885KMT2A 1675/4885

“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.