SCHEMBL2284540

SCHEMBL2284540

COC1CC[S+](c2cccc3ccccc23)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
DRD2 P14416 1/20 0.32
SLC6A4 P31645 1/20 0.32
RAB9A P51151 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP2A6 P11509 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL5972937 0.84 KDM4E (0.34) MEN1KMT2ADRD2SLC6A4RAB9A
SCHEMBL6399791 0.81
Trifluoromethanesulfonic Acid SCHEMBL3366125 0.74 HPGD (0.32) ALDH1A1HPGDACHE
Trifluoromethanesulfonic Acid SCHEMBL3364019 0.71 ALDH1A1 (0.30) ALDH1A1HPGD
SCHEMBL4396369 0.68 MTNR1A (0.40)
SCHEMBL27582162 0.64 HTR7 (0.40) MEN1KMT2ARAB9AL3MBTL1ALDH1A1
SCHEMBL1867896 0.61 ALDH1A1 (0.38) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL248440 0.57 SLC6A4 (0.59) MEN1KMT2ADRD2SLC6A4RAB9A
SCHEMBL30477104 0.57 SLC6A4 (0.59) MEN1KMT2ADRD2SLC6A4RAB9A
SCHEMBL2128946 0.57 ALDH1A1 (0.43) L3MBTL1ALDH1A1CYP2A6HPGD

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-8283104-B2 Sulfonate and its derivative, photosensitive acid generator, and resist composition and patterning process using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-10-09 US disclosed
US-20110189607-A1 NOVEL SULFONIUM SALT, POLYMER, METHOD FOR PRODUCING THE POLYMER, RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-08-04 US disclosed
US-20100209827-A1 NOVEL SULFONATE AND ITS DERIVATIVE, PHOTOSENSITIVE ACID GENERATOR, AND RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-08-19 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 (2 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-20110189607-A1 NOVEL SULFONIUM SALT, POLYMER, METHOD FOR PRODUCING THE POLYMER, RESIST COMPOSITION AND PATTERNING PROCESS RPS4Y1, ETV6, RPS4X MEN1 4079/4885KMT2A 1677/4885DRD2 1783/4885
US-20100209827-A1 NOVEL SULFONATE AND ITS DERIVATIVE, PHOTOSENSITIVE ACID GENERATOR, AND RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME DAP3, MRPS23, ASIC3 MEN1 4475/4885KMT2A 2736/4885DRD2 1612/4885

“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.