SCHEMBL20914732

SCHEMBL20914732

CC(=O)NS(=O)(=O)c1ccc(C(C)(C)O)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
ALDH1A1 P00352 4/20 0.43
PKM P14618 1/20 0.41
DHFR P00374 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
EPHX2 P34913 1/20 0.40
MEP1B Q16820 1/20 0.39
ALKBH2 Q6NS38 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
ALKBH3 Q96Q83 1/20 0.39
FTO Q9C0B1 1/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTT P42858 1/20 0.38
MCL1 Q07820 1/20 0.37
RAPGEF3 O95398 1/20 0.37

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
SCHEMBL20914739 0.81 POLB (0.39) LMNAALDH1A1PKMDHFRTSHR
SCHEMBL16098363 0.79 CA1 (0.52) LMNAALDH1A1PKMDHFRTSHR
SCHEMBL8087037 0.79 ALDH1A1 (0.47) LMNAALDH1A1PKMDHFRTSHR
SCHEMBL20914742 0.78 SMN1; SMN2 (0.61) ALDH1A1PKMDHFRTSHRSMN1; SMN2
SCHEMBL20914744 0.76 NLRP3 (0.56) LMNAALDH1A1PKMDHFRTSHR
SCHEMBL19507910 0.74 PDIA6 (0.49) LMNAALDH1A1PKMKDM4E
SCHEMBL3548718 0.74 CA1 (0.52) LMNAALDH1A1DHFRTSHRSMN1; SMN2
SCHEMBL29927239 0.74 PDIA6 (0.49) LMNAALDH1A1PKMKDM4E
SCHEMBL20914710 0.72 PKM (0.53) LMNAALDH1A1PKMDHFRTSHR
SCHEMBL19507894 0.71 NLRP3 (0.48) RAPGEF3

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 LMNA 1347/4885ALDH1A1 2176/4885PKM 2721/4885

“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.