SCHEMBL22021189

SCHEMBL22021189

COC(=O)c1cc(Cl)c(S(=O)(=O)Cl)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.45
CTPS1 P17812 1/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
PPARG P37231 1/20 0.44
NCOA2 Q15596 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
KDM4E B2RXH2 5/20 0.41
MAPT P10636 4/20 0.41
HPGD P15428 4/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 2/20 0.39
NPC1 O15118 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
DAO P14920 1/20 0.38
CSNK2A2 P19784 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL24978772 0.87 MCL1 (0.45) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL2305822 0.83 MCL1 (0.51) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL22010263 0.82 LMNA (0.42) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL20681176 0.82 LMNA (0.42) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL3019240 0.75 KDM4E (0.46) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL20892550 0.74 MRGPRX4 (0.43) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL11502737 0.73 ABL1 (0.39) LMNANPSR1PPARGNCOA2NCOA1
SCHEMBL2304762 0.71 MCL1 (0.49) MCL1CTPS1LMNANPSR1PPARG
SCHEMBL21962947 0.71 PTGS1 (0.45) MCL1LMNANPSR1PPARGNCOA2
SCHEMBL7370288 0.71 HPGD (0.41) MCL1CTPS1LMNANPSR1PPARG

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-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 US disclosed
WO-2020102096-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-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 MCL1 4130/4885CTPS1 3921/4885LMNA 1699/4885

“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.