SCHEMBL22010548

SCHEMBL22010548

COC(=O)c1cccnc1S(N)(=O)=N[Si](C)(C)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA5A P35218 1/20 0.45
CA9 Q16790 1/20 0.45
SLC40A1 Q9NP59 1/20 0.41
KDM4E B2RXH2 5/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 3/20 0.40
MAP2K1 Q02750 1/20 0.39
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
ALOX5AP P20292 1/20 0.36
CFTR P13569 1/20 0.36
HSD17B10 Q99714 1/20 0.36
P2RX7 Q99572 1/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL22010546 0.85 MAP2K1 (0.41) CA1CA2CA5ACA9SLC40A1
SCHEMBL8629880 0.79 CA1 (0.57) CA1CA2CA5ACA9SLC40A1
SCHEMBL22010547 0.76 SLC40A1 (0.46) CA1CA2CA5ACA9SLC40A1
SCHEMBL29086564 0.74 TDP1 (0.51) CA1CA2CA5ACA9SLC40A1
SCHEMBL21962887 0.74 KDM4E (0.43) CA1CA2CA5ACA9KDM4E
SCHEMBL21962932 0.74 KDM4E (0.47) CA1CA2CA5ACA9KDM4E
SCHEMBL9117916 0.74 SLC40A1 (0.48) CA1CA2CA5ACA9SLC40A1
SCHEMBL23569220 0.73 CA2 (0.38) CA1CA2CA5ACA9KDM4E
SCHEMBL21962927 0.73 CA1 (0.42) CA1CA2CA5ACA9L3MBTL1
SCHEMBL25015231 0.73 CA1 (0.51) CA1CA2CA5ACA9SLC40A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3880666-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-06-28 EP disclosed
US-20230024859-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-01-26 US disclosed
WO-2020102100-A9 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-01-06 WO disclosed
WO-2020102100-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-20230024859-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 CA1 3841/4885CA2 1348/4885CA5A 1703/4885

“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.