SCHEMBL20914710

SCHEMBL20914710

CC(=O)NS(=O)(=O)c1ccc(C)c(C(C)(C)O)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.49
DHFR P00374 1/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.42
EPHX2 P34913 1/20 0.41
BRAF P15056 1/20 0.40
HTT P42858 1/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.39
AKR1C2 P52895 1/20 0.38
AKR1C1 Q04828 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
SCHEMBL29927095 0.76 POLB (0.44) PKMLMNAPOLBHTTKDM4E
SCHEMBL20914742 0.76 SMN1; SMN2 (0.61) PKMSMN1; SMN2DHFRTSHRTDP1
SCHEMBL19507913 0.76 POLB (0.44) PKMLMNAPOLBHTTKDM4E
SCHEMBL16852659 0.74 LMNA (0.41) LMNAPOLB
SCHEMBL20914744 0.74 NLRP3 (0.56) PKMSMN1; SMN2DHFRTSHRTDP1
SCHEMBL848250 0.73 PKM (0.57) PKMSMN1; SMN2DHFRTSHRTDP1
SCHEMBL20914732 0.72 LMNA (0.43) PKMSMN1; SMN2DHFRTSHRTDP1
SCHEMBL20914740 0.72 SMN1; SMN2 (0.51) PKMSMN1; SMN2DHFRTSHRTDP1
SCHEMBL7765176 0.71 LMNA (0.50) PKMSMN1; SMN2TSHRTDP1ALDH1A1
SCHEMBL5931251 0.71 SMN1; SMN2 (0.69) PKMSMN1; SMN2DHFRTSHRTDP1

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 PKM 2721/4885SMN1; SMN2 2412/4885DHFR 3478/4885

“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.