SCHEMBL23744671

SCHEMBL23744671

C[C@@H]1CN(c2cnc(C(F)(F)F)cn2)[C@@H](C)CN1C(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.42
CHRM1 P11229 2/20 0.42
AR P10275 4/20 0.40
CHRM5 P08912 1/20 0.39
CHRM3 P20309 1/20 0.39
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
SLC6A9 P48067 7/20 0.37
HCAR2 Q8TDS4 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL30345609 1.00 CHRM2 (0.42) CHRM2CHRM1ARCHRM5CHRM3
SCHEMBL23728165 0.89 CHRM2 (0.42) CHRM2CHRM1ARCHRM5CHRM3
SCHEMBL26086957 0.89 CHRM2 (0.42) CHRM2CHRM1ARCHRM5CHRM3
SCHEMBL23744338 0.77 TRPV1 (0.42) CHRM2CHRM1ARCHRM3TRPV1
SCHEMBL29862128 0.77 CHRM2 (0.53) CHRM2CHRM1CHRM5CHRM3SLC6A9
SCHEMBL26089136 0.77 TRPV1 (0.42) CHRM2CHRM1ARCHRM3TRPV1
SCHEMBL23459162 0.77 CHRM2 (0.53) CHRM2CHRM1CHRM5CHRM3SLC6A9
SCHEMBL23459165 0.77 CHRM2 (0.53) CHRM2CHRM1CHRM5CHRM3SLC6A9
SCHEMBL28966528 0.75 SMO (0.43) CHRM2CHRM1CHRM5CHRM3NR1H2
SCHEMBL26090056 0.72 AR (0.53) AR

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 CHRM2 2/4885CHRM1 5/4885AR 1161/4885

“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.