SCHEMBL23744756

SCHEMBL23744756

C[C@@H]1CN(c2ccc3nccnc3n2)C[C@H](C)N1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 1/20 0.39
PRKCQ Q04759 2/20 0.39
PRKCD Q05655 2/20 0.39
TLR9 Q9NR96 3/20 0.38
TLR8 Q9NR97 3/20 0.38
TLR7 Q9NYK1 3/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
HDAC1 Q13547 1/20 0.36
PDE10A Q9Y233 3/20 0.35
PIM1 P11309 1/20 0.34
SORD Q00796 2/20 0.33
CDK4 P11802 1/20 0.33
PTPN11 Q06124 1/20 0.33

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
SCHEMBL30345517 1.00 EIF2AK4 (0.39) EIF2AK4PRKCQPRKCDTLR9TLR8
SCHEMBL23744752 0.81 DPP4 (0.40) EIF2AK4PRKCQPRKCDDPP4DPP8
SCHEMBL30345574 0.81 PDE10A (0.48) EIF2AK4PRKCQPRKCDTLR9TLR8
SCHEMBL23744098 0.81 PDE10A (0.48) EIF2AK4PRKCQPRKCDTLR9TLR8
SCHEMBL10508764 0.81 PDE10A (0.48) EIF2AK4PRKCQPRKCDTLR9TLR8
SCHEMBL26087558 0.76 SORD (0.43) EIF2AK4DPP4DPP8DPP9DPP7
SCHEMBL14901231 0.74 PTPN11 (0.38) EIF2AK4HDAC1PTPN11
SCHEMBL19035663 0.72 KDM4E (0.43) EIF2AK4HDAC1SORDCDK4
SCHEMBL20135189 0.72 KDM4E (0.43) EIF2AK4HDAC1SORDCDK4
SCHEMBL6777676 0.72 HRH3 (0.55) PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4100410-B1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES INC (US) 2026-04-22 EP disclosed
US-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-04-27 US disclosed
US-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-04-27 US disclosed
US-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-04-27 US disclosed
WO-2021158698-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-08-12 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-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE CHRM4, CHRM2, CHRM5 EIF2AK4 4671/4885PRKCQ 2600/4885PRKCD 3007/4885

“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.