SCHEMBL25032673

SCHEMBL25032673

COCCN(C)Cc1ccc(S(=N)(N)=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.41
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ PARP1 P09874 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ F10 P00742 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GRM2 Q14416 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36
▸ PRMT8 Q9NR22 1/20 0.36
▸ CA12 O43570 1/20 0.36
▸ BRAF P15056 1/20 0.35

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
SCHEMBL30243539 0.83 HDAC6 (0.39) LTA4HPARP1TSHRSMN1; SMN2GRM2
SCHEMBL22013728 0.79 GRM2 (0.39) LTA4HTSHRSMN1; SMN2GRM2OPRK1
SCHEMBL20698828 0.77 HRH3 (0.48) CA1CA2CA9CA5ACA7
SCHEMBL3151763 0.76 LTA4H (0.47) LTA4HPARP1TSHRKCNH2SMN1; SMN2
SCHEMBL12474 0.74 PYCR1 (0.50) LTA4HPARP1TSHRKCNH2SMN1; SMN2
SCHEMBL26012094 0.73 LTA4H (0.45) LTA4HPARP1TSHRKCNH2F10
SCHEMBL3158691 0.73 KCNH2 (0.66) KCNH2OPRK1TMEM97SIGMAR1
SCHEMBL1239426 0.73 KDM4E (0.59) LTA4HPARP1TSHRSMN1; SMN2MAOB
SCHEMBL16549287 0.73 MEN1 (0.52) LTA4HTSHRF10SMN1; SMN2TMEM97
SCHEMBL615516 0.72 TSHR (0.65) LTA4HTSHRSMN1; SMN2MAOBCARM1

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-11724992-B2 Compounds and compositions for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2023-08-15 — — US disclosed
US-20230062815-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-03-02 — — US disclosed
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 — — US 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 (3 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-20230062815-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 LTA4H 320/4885CA1 3665/4885CA2 1245/4885
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 LTA4H 313/4885CA1 3732/4885CA2 1210/4885
US-11724992-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 LTA4H 320/4885CA1 3665/4885CA2 1245/4885

“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.

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