SCHEMBL23744755

SCHEMBL23744755

C[C@@H]1CN(c2ncc3cc(F)ccc3n2)C[C@H](C)N1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 9/20 0.48
HCRTR2 O43614 9/20 0.48
MAPT P10636 1/20 0.47
PTPN11 Q06124 3/20 0.46
PDE2A O00408 2/20 0.46
PDE10A Q9Y233 2/20 0.46
BCL6 P41182 2/20 0.44
NCOR2 Q9Y618 1/20 0.44
HTR3A P46098 1/20 0.42
SCN9A Q15858 1/20 0.41
HDAC3 O15379 1/20 0.38
CYP3A4 P08684 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL30345727 1.00 HCRTR1 (0.48) HCRTR1HCRTR2MAPTPTPN11PDE2A
SCHEMBL29364564 0.81 HCRTR1 (0.53) HCRTR1HCRTR2MAPTPDE2APDE10A
SCHEMBL6924601 0.81 HCRTR1 (0.53) HCRTR1HCRTR2MAPTPDE2APDE10A
SCHEMBL6772714 0.80 HTR3A (0.57) PTPN11PDE10AHTR3A
SCHEMBL6772712 0.80 HTR3A (0.57) PTPN11PDE10AHTR3A
SCHEMBL30345365 0.80 HTR3A (0.57) PTPN11PDE10AHTR3A
SCHEMBL23744191 0.80 HTR3A (0.57) PTPN11PDE10AHTR3A
SCHEMBL30345535 0.80 HTR3A (0.57) PTPN11PDE10AHTR3A
Hydrochloric Acid SCHEMBL29367009 0.80 HCRTR1 (0.53) HCRTR1HCRTR2MAPTPDE2APDE10A
SCHEMBL26089984 0.79 HCRTR1 (0.52) HCRTR1HCRTR2MAPTPDE2APDE10A

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 HCRTR1 210/4885HCRTR2 183/4885MAPT 1187/4885

“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.