SCHEMBL23744150

SCHEMBL23744150

O=C(NC1CCN(Cc2ccccc2)CC1)N1CCN(c2ncc(C(F)(F)F)cn2)CC1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 9/20 0.75
CHRM1 P11229 6/20 0.75
DPP7 Q9UHL4 1/20 0.60
CHRM3 P20309 3/20 0.59
SIGMAR1 Q99720 4/20 0.58
CHRM4 P08173 4/20 0.57
CHRM5 P08912 1/20 0.54
UBE2M P61081 1/20 0.53
DCUN1D1 Q96GG9 1/20 0.53
SLC6A5 Q9Y345 1/20 0.52

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
SCHEMBL23744108 0.89 CHRM2 (0.76) CHRM2CHRM1DPP7CHRM3SIGMAR1
SCHEMBL26087044 0.87 CHRM2 (0.63) CHRM2CHRM1DPP7CHRM3SIGMAR1
SCHEMBL29432013 0.86 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL23744066 0.85 CHRM1 (0.77) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL23744069 0.85 CHRM2 (0.57) CHRM2CHRM1DPP7CHRM3SIGMAR1
SCHEMBL23744070 0.85 CHRM1 (0.77) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL23744382 0.85 CHRM1 (0.61) CHRM2CHRM1DPP7CHRM3SIGMAR1
SCHEMBL23744585 0.85 CHRM2 (0.77) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL23744640 0.85 CHRM2 (0.77) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL26433226 0.83 CHRM2 (0.53) CHRM2CHRM1DPP7CHRM3SIGMAR1

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 5/4885DPP7 2145/4885

“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.