SCHEMBL26429417

SCHEMBL26429417

COc1cncc(N2C[C@@H](C)N(C(=O)OC3CC4(C3)CN(Cc3ccccc3)C4)C[C@H]2C)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 8/20 0.39
HDAC1 Q13547 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35
MAPK14 Q16539 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP2D6 P10635 2/20 0.34
GHSR Q92847 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
CYP3A4 P08684 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
KCNH2 Q12809 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL26429414 1.00 CHRM4 (0.39) CHRM4HDAC1HRH3MAPK14ALDH1A1
SCHEMBL23744618 0.87 CHRM4 (0.47) CHRM4HRH3
SCHEMBL23744614 0.87 CHRM4 (0.47) CHRM4HRH3
SCHEMBL26429445 0.87 CHRM2 (0.37) CHRM4HDAC1KCNH2USP2
SCHEMBL26429441 0.87 CHRM2 (0.37) CHRM4HDAC1KCNH2USP2
SCHEMBL26429430 0.85 HCAR2 (0.49) CHRM4HDAC1ALDH1A1CYP2D6GHSR
SCHEMBL26429431 0.85 HCAR2 (0.49) CHRM4HDAC1ALDH1A1CYP2D6GHSR
SCHEMBL30345594 0.83 HCAR2 (0.41) CHRM4HDAC1MAPK14ALDH1A1CYP2D6
SCHEMBL30345588 0.83 HCAR2 (0.41) CHRM4HDAC1MAPK14ALDH1A1CYP2D6
SCHEMBL26429456 0.83 HCAR2 (0.41) CHRM4HDAC1MAPK14ALDH1A1CYP2D6

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 claimed
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

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 CHRM4 1/4885HDAC1 1545/4885HRH3 104/4885

“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.