SCHEMBL30157129

SCHEMBL30157129

CC(=O)N1Cc2c(N[C@@H]3CCCC[C@H]3O)nnc(-c3ccc(C(F)(F)F)cc3O)c2C1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 6/20 0.67
▸ KCNH2 Q12809 1/20 0.67
▸ IL1B P01584 8/20 0.45
▸ TNF P01375 2/20 0.41
▸ BRD4 O60885 3/20 0.36
▸ CREBBP Q92793 3/20 0.36
▸ CNR1 P21554 2/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 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
SCHEMBL27224429 1.00 NLRP3 (0.67) NLRP3KCNH2IL1BTNFBRD4
SCHEMBL27224451 0.93 NLRP3 (0.63) NLRP3KCNH2IL1BTNFBRD4
SCHEMBL30157058 0.93 NLRP3 (0.63) NLRP3KCNH2IL1BTNFBRD4
SCHEMBL27224457 0.89 NLRP3 (0.62) NLRP3KCNH2IL1BTNFCNR1
SCHEMBL30932818 0.89 NLRP3 (0.62) NLRP3KCNH2IL1BTNFCNR1
SCHEMBL30157075 0.89 NLRP3 (0.72) NLRP3KCNH2IL1BTNF
SCHEMBL27224458 0.89 NLRP3 (0.72) NLRP3KCNH2IL1BTNF
SCHEMBL27224470 0.84 NLRP3 (0.59) NLRP3KCNH2IL1BTNF
SCHEMBL30932875 0.84 NLRP3 (0.59) NLRP3KCNH2IL1BTNF
SCHEMBL30156937 0.84 NLRP3 (0.67) NLRP3KCNH2IL1BTNF

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-20250084092-A1 ANNULATED PYRIDAZINE COMPOUND NICO THERAPEUTICS, INC. 2025-03-13 — — US disclosed
CN-118234711-A Cyclopyridazine compounds 尼科治疗有限公司 2024-06-21 — — CN disclosed
WO-2023003002-A1 ANNULATED PYRIDAZINE COMPOUND アステラス製薬株式会社 2023-01-26 — — 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-20250084092-A1 ANNULATED PYRIDAZINE COMPOUND NLRP3, NLRP1, PYCARD NLRP3 1/4885KCNH2 1608/4885IL1B 17/4885

“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.

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