SCHEMBL22012162

SCHEMBL22012162

NC(=O)Nc1c2c(cc3c1CC3)CCC2

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 17/20 0.50
ALDH1A1 P00352 1/20 0.50
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL18029669 0.96 NLRP3 (0.53) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL29494713 0.94 NLRP3 (0.51) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL25845405 0.94 NLRP3 (0.51) NLRP3ALDH1A1ATMSMN1; SMN2
Potassium SCHEMBL29676171 0.94 NLRP3 (0.51) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL22012974 0.86 NLRP3 (0.46) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL25842031 0.84 NLRP3 (0.45) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL20681634 0.83 NLRP3 (0.51) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL20692209 0.82 NLRP3 (0.45) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL22013712 0.81 NLRP3 (0.54) NLRP3ALDH1A1ATMSMN1; SMN2
SCHEMBL25524236 0.81 ATM (0.42) NLRP3ALDH1A1ATMSMN1; SMN2

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
EP-3880666-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-06-28 EP disclosed
WO-2020102576-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 WO 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-11724992-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 NLRP3 2/4885ALDH1A1 1972/4885ATM 3677/4885

“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.