SCHEMBL23744724

SCHEMBL23744724

C[C@@H]1CN(c2cnc3cc(F)ccc3n2)[C@@H](C)CN1C(=O)OC1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
HCAR2 Q8TDS4 1/20 0.39
CCR1 P32246 3/20 0.39
CCR3 P51677 1/20 0.39
CHRM4 P08173 2/20 0.38
ENPP2 Q13822 2/20 0.38
GRM2 Q14416 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
ADRB2 P07550 1/20 0.37
GAA P10253 1/20 0.37
PRKAA2 P54646 1/20 0.36

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
SCHEMBL23744451 0.95 HCAR2 (0.44) CHRM2CHRM1HCAR2CCR3CHRM4
SCHEMBL23744471 0.94 CHRM4 (0.38) CHRM2CHRM1HCAR2CCR1CCR3
SCHEMBL23744736 0.93 PRKAA2 (0.41) CCR1CCR3PRKAA2
SCHEMBL23744723 0.92 HCAR2 (0.47) CHRM2CHRM1HCAR2CCR1CCR3
SCHEMBL30345503 0.89 HCAR2 (0.37) HCAR2CCR1ENPP2PTGDR2
SCHEMBL26429666 0.89 HCAR2 (0.37) HCAR2CCR1ENPP2PTGDR2
SCHEMBL23744259 0.86 HCAR2 (0.51) CHRM2CHRM1HCAR2CHRM4
SCHEMBL23744257 0.86 HCAR2 (0.51) CHRM2CHRM1HCAR2CHRM4
SCHEMBL23744636 0.86 CHRM2 (0.46) CHRM2CHRM1HCAR2CHRM4
SCHEMBL23744584 0.85 HCAR2 (0.42) HCAR2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 5/4885HCAR2 76/4885

“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.