SCHEMBL21963334

SCHEMBL21963334

Clc1nc2c(c3c1CCC3)CCC2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.48
NSD2 O96028 1/20 0.48
ACHE P22303 10/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
BPTF Q12830 1/20 0.44
GRIN1 Q05586 5/20 0.38
GRIN2A Q12879 5/20 0.38
BCHE P06276 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 2/20 0.36
CHRM1 P11229 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL30777931 0.78 ACHE (0.43) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL633261 0.78 ACHE (0.43) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL1069076 0.75 KDM4E (0.41) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL2922186 0.75 KDM4E (0.53) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL3296038 0.75 ACHE (0.61) MAPK1ACHEMEN1KMT2ABPTF
SCHEMBL21963258 0.74 ACHE (0.54) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL29466623 0.73 MAPK1 (0.47) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL1819184 0.73 MAPK1 (0.47) MAPK1NSD2ACHEMEN1KMT2A
SCHEMBL3293093 0.73 ACHE (0.59) MAPK1ACHEMEN1KMT2ABPTF
SCHEMBL23816987 0.71 MAPK1 (0.46) MAPK1NSD2ACHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4667054-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2025-12-24 EP disclosed
EP-3880660-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2025-07-02 EP disclosed
US-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 US disclosed
US-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 US disclosed
EP-3880660-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-09-22 EP disclosed
WO-2020102096-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-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 MAPK1 1647/4885NSD2 4299/4885ACHE 4177/4885

“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.