SCHEMBL22020692

SCHEMBL22020692

COC(=O)c1cnc(S(C)(=O)=O)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
NCOA1 Q15788 2/20 0.45
NCOA3 Q9Y6Q9 2/20 0.45
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
CSNK2A2 P19784 1/20 0.39
KDR P35968 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
FFAR2 O15552 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
KDM4E B2RXH2 4/20 0.36
MAPT P10636 1/20 0.36
CRBN Q96SW2 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPK1 P28482 4/20 0.35
HRH3 Q9Y5N1 2/20 0.34
HPGD P15428 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34

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
SCHEMBL14164240 0.85 LMNA (0.44) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL19475255 0.85 NCOA1 (0.44) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL24667434 0.84 HCAR2 (0.55) LMNAFFAR2HCAR2KDM4EMAPT
SCHEMBL3123965 0.79 KDR (0.39) CSNK2A2KDRCSNK2BCSNK2A1FFAR2
SCHEMBL25224893 0.76 ALDH1A1 (0.43) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL567672 0.76 HCAR2 (0.34) NPSR1HCAR2MAPTALDH1A1MAPK1
SCHEMBL1107386 0.74 HCAR2 (0.68) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL472995 0.74 CSNK2A2 (0.42) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL4292895 0.74 HCAR2 (0.42) LMNANPSR1NCOA1NCOA3PPARG
SCHEMBL16742919 0.74 FFAR2 (0.45) LMNANPSR1NCOA1NCOA3PPARG

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-20220280476-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2022-09-08 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-20220280476-A1 KCNT1 INHIBITORS AND METHODS OF USE KCNT1, KCNT2, KCNQ2 LMNA 1423/4885NPSR1 2433/4885NCOA1 3979/4885

“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.