SCHEMBL23775898

SCHEMBL23775898

CCOC(=O)C1=CCN(S(=O)(=O)c2cccc(Br)c2)C1c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 1/20 0.41
NOD1 Q9Y239 1/20 0.41
GPR183 P32249 1/20 0.39
USP2 O75604 1/20 0.39
CNR1 P21554 1/20 0.39
ACHE P22303 4/20 0.39
BCHE P06276 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MMP2 P08253 1/20 0.38
TLR4 O00206 3/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37

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
SCHEMBL23775900 0.93 KDM4E (0.41) USP2L3MBTL1MMP2GAAALDH1A1
SCHEMBL19726316 0.92 BCHE (0.44) NOD2NOD1ACHEBCHEL3MBTL1
SCHEMBL23775963 0.91 USP2 (0.43) NOD2NOD1USP2ACHEBCHE
SCHEMBL23775863 0.91 MGAM (0.46) NOD2NOD1ACHEBCHEMMP2
SCHEMBL23776084 0.91 NOD2 (0.46) NOD2NOD1USP2CNR1ACHE
SCHEMBL23776110 0.88 L3MBTL1 (0.44) NOD2NOD1ACHEBCHEL3MBTL1
SCHEMBL23776071 0.88 L3MBTL1 (0.44) NOD2NOD1ACHEBCHEL3MBTL1
SCHEMBL19726326 0.87 L3MBTL1 (0.42) NOD2NOD1USP2ACHEBCHE
SCHEMBL23775874 0.87 L3MBTL1 (0.48) NOD2NOD1USP2ACHEBCHE
SCHEMBL23775965 0.86 ACHE (0.47) NOD2NOD1ACHEBCHEL3MBTL1

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-20230150935-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CALCIUM ION HOMEOSTASIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-05-18 US disclosed
US-20230150935-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CALCIUM ION HOMEOSTASIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-05-18 US disclosed
WO-2021163493-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CALCIUM ION HOMEOSTASIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-08-19 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-20230150935-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CALCIUM ION HOMEOSTASIS CHERP, ATP2A1, ATP2A3 NOD2 1593/4885NOD1 2577/4885GPR183 2731/4885

“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.