SCHEMBL20914740

SCHEMBL20914740

CC(=O)NS(=O)(=O)c1ccc(C(C)(C)O)nc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
DHFR P00374 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PKM P14618 2/20 0.47
BRAF P15056 1/20 0.45
HTT P42858 1/20 0.45
POLB P06746 1/20 0.44
EPHX2 P34913 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAP4K4 O95819 1/20 0.42
KDM4E B2RXH2 1/20 0.41
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL10148935 0.79 SMN1; SMN2 (0.62) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL15625448 0.79 EGFR (0.56) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL20914742 0.78 SMN1; SMN2 (0.61) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL22012887 0.77 ABCC9 (0.36) SMN1; SMN2HTTPOLBALDH1A1KDM4E
SCHEMBL29653635 0.74 CA2 (0.46) TSHRTDP1KDM4EPTGS2
SCHEMBL19508116 0.74 CA2 (0.46) TSHRTDP1KDM4EPTGS2
SCHEMBL22020764 0.73 POLB (0.35) SMN1; SMN2POLBKDM4E
SCHEMBL7712520 0.73 EPHX2 (0.69) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL19519045 0.72 NLRP3 (0.66)
SCHEMBL20914710 0.72 PKM (0.53) SMN1; SMN2DHFRTSHRTDP1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190119241-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2019-04-25 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 (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-20190119241-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 SMN1; SMN2 2412/4885DHFR 3478/4885TSHR 4318/4885

“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.