SCHEMBL23744256

SCHEMBL23744256

C[C@@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1C(=O)OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
HCAR2 Q8TDS4 1/20 0.50
CHRM2 P08172 8/20 0.48
CHRM1 P11229 4/20 0.48
CHRM3 P20309 3/20 0.48
CHRM5 P08912 2/20 0.48
CHRM4 P08173 7/20 0.47
BCHE P06276 1/20 0.44

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
SCHEMBL23744206 1.00 NPC1 (0.54) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744062 0.94 NPC1 (0.47) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744456 0.91 CHRM4 (0.47) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744655 0.91 CHRM4 (0.47) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744179 0.90 CHRM2 (0.47) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744637 0.90 CHRM4 (0.45) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL23744703 0.89 CHRM2 (0.49) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL23744576 0.86 CHRM2 (0.46) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL23744207 0.86 HCAR2 (0.48) NPC1RAB9AHCAR2CHRM2CHRM1
SCHEMBL26429428 0.86 HCAR2 (0.48) NPC1RAB9AHCAR2CHRM2CHRM1

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 NPC1 1236/4885RAB9A 3190/4885HCAR2 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.