SCHEMBL31199643

SCHEMBL31199643

CCC(=O)C1CN(c2ccc(-c3c(C)cc(C)cc3O)nn2)CCO1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 6/20 0.41
IL1B P01584 6/20 0.41
TNF P01375 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
CNR2 P34972 2/20 0.34
NPC1 O15118 6/20 0.34
RAB9A P51151 6/20 0.34
KCNH2 Q12809 1/20 0.34
GRIN2B Q13224 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
SCHEMBL31199459 1.00 NLRP3 (0.41) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199427 1.00 NLRP3 (0.41) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199581 0.89 IL1B (0.43) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199686 0.89 IL1B (0.43) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199340 0.86 IL1B (0.41) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199466 0.86 GRIN2B (0.45) NLRP3IL1BNPC1RAB9AGRIN2B
SCHEMBL31199324 0.86 GRIN2B (0.45) NLRP3IL1BNPC1RAB9AGRIN2B
SCHEMBL31200647 0.83 IL1B (0.42) NLRP3IL1BTNFPDK1PDK2
SCHEMBL31199817 0.83 IL1B (0.45) NLRP3IL1BTNFCNR2
SCHEMBL31199314 0.83 IL1B (0.45) NLRP3IL1BTNFCNR2

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-4680601-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES Sanofi (FR) 2026-01-21 EP claimed
US-20240360151-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-10-31 US claimed
WO-2024188994-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-09-19 WO claimed
EP-4680601-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES Sanofi (FR) 2026-01-21 EP disclosed
US-20240360151-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-10-31 US disclosed
WO-2024188994-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES SANOFI (FR) 2024-09-19 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-20240360151-A1 PYRIDAZINE COMPOUNDS, THEIR PREPARATION, AND THEIR THERAPEUTIC USES NLRP3, NOD1, NLRP1 NLRP3 1/4885IL1B 66/4885TNF 2557/4885

“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.