SCHEMBL26772298

SCHEMBL26772298

Cc1cc(-c2ccccc2O)nnc1N[C@@H]1CCCN(CCF)C1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IL1B P01584 14/20 0.58
NLRP3 Q96P20 7/20 0.47
KCNH2 Q12809 1/20 0.44
TNF P01375 2/20 0.43
CHEK2 O96017 1/20 0.43

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
SCHEMBL26772301 0.89 IL1B (0.59) IL1BNLRP3KCNH2TNF
SCHEMBL26772113 0.86 IL1B (0.73) IL1BNLRP3CHEK2
SCHEMBL26117680 0.82 NLRP3 (0.52) IL1BNLRP3CHEK2
SCHEMBL26117671 0.82 NLRP3 (0.52) IL1BNLRP3CHEK2
SCHEMBL26772182 0.82 NLRP3 (0.61) IL1BNLRP3KCNH2TNF
SCHEMBL31359831 0.77 NLRP3 (0.45) IL1BNLRP3CHEK2
SCHEMBL26112514 0.77 NLRP3 (0.45) IL1BNLRP3CHEK2
SCHEMBL26112505 0.77 NLRP3 (0.45) IL1BNLRP3CHEK2
SCHEMBL26772275 0.76 IL1B (0.74) IL1BNLRP3
SCHEMBL26772270 0.76 IL1B (0.76) IL1BNLRP3

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-20230365534-A1 MODULATORS OF NLRP3 INFLAMMASOME AND RELATED PRODUCTS AND METHODS Neumora Therapeutics, Inc. 2023-11-16 US disclosed
US-20230365534-A1 MODULATORS OF NLRP3 INFLAMMASOME AND RELATED PRODUCTS AND METHODS Neumora Therapeutics, Inc. 2023-11-16 US disclosed
WO-2023220408-A1 MODULATORS OF NLRP3 INFLAMMASOME AND RELATED PRODUCTS AND METHODS Neumora Therapeutics, Inc. (US) 2023-11-16 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-20230365534-A1 MODULATORS OF NLRP3 INFLAMMASOME AND RELATED PRODUCTS AND METHODS NLRP3, NLRP1, PYCARD IL1B 9/4885NLRP3 1/4885KCNH2 2023/4885

“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.