SCHEMBL723065

SCHEMBL723065

NC1CCCN(c2ccccn2)C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.51
MAP4K4 O95819 2/20 0.49
PLD1 Q13393 1/20 0.47
PBK Q96KB5 1/20 0.47
KDM4E B2RXH2 2/20 0.46
DPP4 P27487 1/20 0.46
GRM1 Q13255 1/20 0.46
HRH4 Q9H3N8 2/20 0.46
KAT2B Q92831 1/20 0.46
DOT1L Q8TEK3 1/20 0.45
GPBAR1 Q8TDU6 1/20 0.45
POLB P06746 1/20 0.44
PIM1 P11309 2/20 0.44

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
SCHEMBL29683665 1.00 PRKCQ (0.53) PRKCQIRAK4MAP4K4PLD1PBK
SCHEMBL3153901 0.90 HRH4 (0.51) PRKCQPLD1DPP4HRH4
SCHEMBL3154404 0.90 HRH4 (0.51) PRKCQPLD1DPP4HRH4
SCHEMBL3658830 0.90 HRH4 (0.51) PRKCQPLD1DPP4HRH4
Hydrochloric Acid SCHEMBL1402092 0.89 HRH4 (0.50) PRKCQPLD1DPP4GRM1HRH4
Hydrochloric Acid SCHEMBL1402090 0.89 HRH4 (0.50) PRKCQPLD1DPP4GRM1HRH4
SCHEMBL30599887 0.83 PLD1 (0.52) PLD1KDM4EDPP4GRM1HRH4
SCHEMBL2002068 0.83 PLD1 (0.52) PLD1KDM4EDPP4GRM1HRH4
SCHEMBL19844779 0.81 GRM1 (0.52) MAP4K4PLD1KDM4EGRM1KAT2B
SCHEMBL13572999 0.81 GRM1 (0.52) MAP4K4PLD1KDM4EGRM1KAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO claimed
JP-2007523865-A 2007-08-23 JP claimed
EP-1646621-A2 NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN Abbott Laboratories (US) 2006-04-19 EP claimed
WO-2005007642-A2 NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2005-01-27 WO claimed
US-20250340563-A1 FUSED PYRIDAZINE DERIVATIVES AS NLRP3 INHIBITORS TAKEDA DEVELOPMENT CENTER AMERICAS, INC. 2025-11-06 US disclosed
EP-4504733-A1 FUSED PYRIDAZINE DERIVATIVES AS NLRP3 INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2025-02-12 EP disclosed
EP-3983078-B1 NEXT-GENERATION MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) RYVU THERAPEUTICS S A (PL) 2023-11-15 EP disclosed
WO-2023194964-A1 FUSED PYRIDAZINE DERIVATIVES AS NLRP3 INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-12 WO disclosed
US-9914712-B2 Antibacterial thiazolecarboxylic acids ANTABIO SAS (FR) 2018-03-13 US 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-20250340563-A1 FUSED PYRIDAZINE DERIVATIVES AS NLRP3 INHIBITORS NLRP3, NLRP1, NOD1 PRKCQ 2119/4885IRAK4 20/4885MAP4K4 3443/4885

“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.