SCHEMBL2316644

SCHEMBL2316644

O=S(=O)(c1ccccc1)C1C=CCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ALDH1A1 P00352 5/20 0.41
ACHE P22303 1/20 0.38
HTR2A P28223 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
AKR1C3 P42330 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KCNH2 Q12809 2/20 0.36
HTR2C P28335 1/20 0.36
HTR6 P50406 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 2/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
GBA1 P04062 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 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
SCHEMBL28096920 0.83 ALDH1A1 (0.41) MAPTALDH1A1ACHEKDM4EKMT2A
SCHEMBL27891264 0.76 MAPT (0.49) MAPTALDH1A1ACHEHTR2AKDM4E
SCHEMBL2866973 0.72
SCHEMBL12269802 0.70 ALDH1A1 (0.58) ALDH1A1ACHEHTR2AKDM4EMEN1
SCHEMBL5075753 0.69 MAPT (0.38) MAPTALDH1A1HTR2AKMT2AAKR1C3
SCHEMBL13909334 0.69 AKR1C3 (0.40) MAPTALDH1A1HTR2AKDM4EMEN1
SCHEMBL11469736 0.69 MAPT (0.45) MAPTALDH1A1ACHEHTR2AKDM4E
SCHEMBL30833771 0.69
SCHEMBL777971 0.69 MAPT (0.56) MAPTALDH1A1ACHEHTR2AKDM4E
SCHEMBL7541817 0.69 HTR2A (0.56) MAPTALDH1A1ACHEHTR2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118076916-A Sealing agent for liquid crystal display element, and polyhydrazide compound 积水化学工业株式会社 2024-05-24 CN disclosed
WO-2023120683-A1 SEALING AGENT FOR LIQUID CRYSTAL DISPLAY ELEMENTS, LIQUID CRYSTAL DISPLAY ELEMENT AND POLYVALENT HYDRAZIDE COMPOUND 積水化学工業株式会社 2023-06-29 WO disclosed
US-8354431-B2 Aryl carboxylic acid cyclohexyl amide derivatives NOVARTIS AG (CH) 2013-01-15 US disclosed
US-8354431-B2 Aryl carboxylic acid cyclohexyl amide derivatives NOVARTIS AG (CH) 2013-01-15 US disclosed
US-8354431-B2 Aryl carboxylic acid cyclohexyl amide derivatives NOVARTIS AG (CH) 2013-01-15 US disclosed
EP-2125782-B1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2011-08-03 EP disclosed
EP-2125782-B1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2011-08-03 EP disclosed
US-20100016361-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2010-01-21 US disclosed
US-20100016361-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2010-01-21 US disclosed
US-20100016361-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2010-01-21 US disclosed
EP-2125782-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES Novartis AG (CH) 2009-12-02 EP disclosed
WO-2008101905-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2008-08-28 WO disclosed
WO-2008101905-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2008-08-28 WO 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-20100016361-A1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES CYP2D6, CYP2B6, CYP2C9 MAPT 2924/4885ALDH1A1 123/4885ACHE 3548/4885

“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.