SCHEMBL23744648

SCHEMBL23744648

C[C@@H]1CN(c2nc3ccc(C#N)cc3s2)[C@@H](C)CN1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
USP30 Q70CQ3 3/20 0.41
DYRK1A Q13627 1/20 0.40
APP P05067 3/20 0.40
CSNK1D P48730 1/20 0.38
CSNK1G2 P78368 1/20 0.38
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CXCR3 P49682 1/20 0.35
DPP4 P27487 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
PIM1 P11309 1/20 0.33
PRKCI P41743 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
SCHEMBL30345543 1.00 NR1H2 (0.44) NR1H2NR1H3USP30DYRK1AAPP
SCHEMBL30345371 0.82 NPC1 (0.50) NR1H2NR1H3USP30MAPTKMT2A
SCHEMBL10219137 0.82 NPC1 (0.49) MAPTKMT2A
SCHEMBL23744490 0.82 NPC1 (0.50) NR1H2NR1H3USP30MAPTKMT2A
SCHEMBL23744492 0.81 MAPT (0.52) MAPT
SCHEMBL23744493 0.80 PPARD (0.49) DYRK1ACSNK1D
SCHEMBL10219141 0.80 PPARD (0.49) DYRK1ACSNK1D
SCHEMBL23744657 0.79 RAB9A (0.43) MAPTKMT2ANPSR1
SCHEMBL23744378 0.79 NR1H2 (0.44) NR1H2NR1H3USP30DYRK1AAPP
SCHEMBL23744369 0.79 NR1H2 (0.44) NR1H2NR1H3USP30DYRK1AAPP

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 NR1H2 444/4885NR1H3 485/4885USP30 3386/4885

“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.