SCHEMBL29270337

SCHEMBL29270337

CCN1CCC[C@@H](Nc2cc(C(F)(F)F)c(Cl)nn2)C1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IL1B P01584 11/20 0.53
NLRP3 Q96P20 9/20 0.53
KCNH2 Q12809 1/20 0.53
TNF P01375 1/20 0.43
CAMK2D Q13557 2/20 0.43
HTR2A P28223 1/20 0.42

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
SCHEMBL30833884 0.87 IL1B (0.55) IL1BNLRP3KCNH2TNF
SCHEMBL30833975 0.87 IL1B (0.55) IL1BNLRP3KCNH2TNF
SCHEMBL22654864 0.85 IL1B (0.66) IL1BNLRP3
SCHEMBL22654862 0.85 IL1B (0.66) IL1BNLRP3
SCHEMBL30517832 0.83 NLRP3 (0.57) IL1BNLRP3KCNH2TNFCAMK2D
SCHEMBL25519368 0.83 NLRP3 (0.57) IL1BNLRP3KCNH2TNFCAMK2D
SCHEMBL29270330 0.82 NLRP3 (0.57) IL1BNLRP3KCNH2CAMK2D
SCHEMBL31021469 0.81 NLRP3 (0.48) IL1BNLRP3KCNH2TNFCAMK2D
SCHEMBL25798971 0.81 IL1B (0.51) IL1BNLRP3KCNH2TNF
SCHEMBL30665802 0.79 IL1B (0.49) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353830-A1 NOVEL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-11-20 US disclosed
CN-119300833-A Novel compounds 豪夫迈·罗氏有限公司 2025-01-10 CN disclosed
US-20240308977-A1 PYRIDAZINE DERIVATIVES AS INHIBITORS OF NLRP3 HOFFMANN-LA ROCHE INC. (US) 2024-09-19 US disclosed
CN-118265701-A Pyridazine derivatives as inhibitors of NLRP3 豪夫迈·罗氏有限公司 2024-06-28 CN 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 (2 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-20240308977-A1 PYRIDAZINE DERIVATIVES AS INHIBITORS OF NLRP3 NLRP3, NLRP1, PYCARD IL1B 8/4885NLRP3 1/4885KCNH2 867/4885
US-20250353830-A1 NOVEL COMPOUNDS UQCRB, CCNB3, C5 IL1B 2984/4885NLRP3 3745/4885KCNH2 1209/4885

“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.