SCHEMBL22012059

SCHEMBL22012059

CN1CCc2cc(S(=O)(=O)Cl)sc2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.41
PARP1 P09874 3/20 0.40
PARP2 Q9UGN5 3/20 0.40
WDR91 A4D1P6 1/20 0.39
MAOA P21397 4/20 0.37
MAOB P27338 4/20 0.37
DRD2 P14416 3/20 0.37
DRD3 P35462 3/20 0.37
HTR2C P28335 1/20 0.37
HTR6 P50406 1/20 0.37
DRD1 P21728 2/20 0.36
DRD4 P21917 2/20 0.36
DRD5 P21918 2/20 0.36
SLC6A4 P31645 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.33

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
SCHEMBL25796673 0.88 F10 (0.41) F10PARP1PARP2MAOAMAOB
SCHEMBL22012060 0.84 CA2 (0.43) F10PARP1PARP2WDR91MAOA
SCHEMBL31054271 0.83 CA2 (0.42) F10PARP1PARP2WDR91MAOA
SCHEMBL30244447 0.82 PARP1 (0.38) F10PARP1PARP2WDR91MAOA
SCHEMBL3652903 0.78 HDAC6 (0.40) F10MAOBALDH1A1
SCHEMBL10513565 0.75 PARP1 (0.43) F10PARP1PARP2WDR91MAOA
SCHEMBL22012058 0.74 DRD2 (0.36) F10PARP1PARP2WDR91DRD2
SCHEMBL3010467 0.74 ESR2 (0.50) KDM4EMAPTADORA1
SCHEMBL17850513 0.73 ALDH1A1 (0.46) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL8054291 0.73 MAOA (0.44) PARP1PARP2WDR91MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
WO-2020102576-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 F10 3512/4885PARP1 2052/4885PARP2 3257/4885

“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.