SCHEMBL25067262

SCHEMBL25067262

Cc1c(O)c(C2CC2)cc2c1CCC2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
UGT2B17 O75795 2/20 0.34
NLRP3 Q96P20 2/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL21962225 0.79 MEN1 (0.36) MEN1KMT2AKDM4EMAPT
SCHEMBL8922080 0.77 MEN1 (0.43) MEN1KMT2ANLRP3KDM4EMAPT
SCHEMBL21962348 0.77 UGT2B17 (0.32) UGT2B17MAPTALDH1A1HTTACHE
SCHEMBL21962062 0.74 KDM4E (0.38) NLRP3KDM4EMAPT
SCHEMBL22011027 0.72 UGT2B17 (0.49) MEN1KMT2AUGT2B17NLRP3MAPT
SCHEMBL25033144 0.72 UGT2B17 (0.49) MEN1KMT2AUGT2B17NLRP3MAPT
SCHEMBL22010660 0.72 UGT2B17 (0.49) MEN1KMT2AUGT2B17NLRP3MAPT
SCHEMBL25842400 0.70 NLRP3 (0.33) NLRP3MAPTALDH1A1HTT
SCHEMBL21962290 0.70 GRIN2D (0.45) MEN1KMT2ANLRP3MAPTALDH1A1
SCHEMBL21586529 0.70 MAPT (0.43) MEN1KMT2ANLRP3MAPTALDH1A1

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-20230059136-A1 THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-23 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-20230059136-A1 THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 MEN1 3797/4885KMT2A 4479/4885UGT2B17 1099/4885

“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.