SCHEMBL23744735

SCHEMBL23744735

COc1ccc2nc(N3C[C@@H](C)N(C(=O)OC4CCN(Cc5ccc(F)cc5)CC4)[C@@H](C)C3)cnc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
CHRM4 P08173 2/20 0.42
PRKAA2 P54646 2/20 0.42
CHRM2 P08172 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR1A P08908 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
ACHE P22303 1/20 0.41
CACNA1G O43497 1/20 0.40
CCR3 P51677 1/20 0.40
PRKAB2 O43741 1/20 0.40
PRKAG1 P54619 1/20 0.40
PRKAA1 Q13131 1/20 0.40
PRKAG3 Q9UGI9 1/20 0.40
PRKAG2 Q9UGJ0 1/20 0.40

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
SCHEMBL23744637 0.93 CHRM4 (0.45) HRH3CHRM4CHRM2ACHEKDM4E
SCHEMBL26435008 0.92 HRH3 (0.43) HRH3CHRM4CHRM2HCRTR1HCRTR2
SCHEMBL26434902 0.92 CHEK2 (0.46) HRH3CHRM4HCRTR1HCRTR2
SCHEMBL26429662 0.89 HCRTR1 (0.37) HRH3CHRM4PRKAA2HTR3EHTR3B
SCHEMBL23744062 0.88 NPC1 (0.47) CHRM4CHRM2MEN1KMT2ACCR3
SCHEMBL23744713 0.88 CHRM4 (0.47) CHRM4PRKAA2CHRM2
SCHEMBL23744655 0.88 CHRM4 (0.47) CHRM4CHRM2CCR3
SCHEMBL23744456 0.88 CHRM4 (0.47) CHRM4CHRM2CCR3
SCHEMBL23744736 0.86 PRKAA2 (0.41) HRH3PRKAA2MEN1KMT2AACHE
SCHEMBL23744256 0.82 NPC1 (0.54) CHRM4CHRM2

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 HRH3 104/4885CHRM4 1/4885PRKAA2 3911/4885

“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.