SCHEMBL30345779

SCHEMBL30345779

C[C@@H]1CN(c2cnc(C(F)(F)F)cn2)[C@@H](C)CN1C(=O)OC1(C(F)F)CC2(CN(Cc3ccccc3)C2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 11/20 0.46
CHRM1 P11229 9/20 0.46
CHRM3 P20309 6/20 0.43
CHRM5 P08912 2/20 0.43
CHRM4 P08173 4/20 0.39
HDAC1 Q13547 1/20 0.37
PDK1 Q15118 1/20 0.34
PDK2 Q15119 1/20 0.34
PDK3 Q15120 1/20 0.34
PDK4 Q16654 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL26429584 1.00 CHRM2 (0.46) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429604 0.91 CHRM2 (0.48) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL30345580 0.91 CHRM2 (0.48) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL23744613 0.89 CHRM2 (0.50) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429590 0.89 CHRM2 (0.57) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL30345511 0.89 CHRM2 (0.57) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429583 0.86 CHRM2 (0.44) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429581 0.86 CHRM2 (0.55) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429576 0.86 CHRM2 (0.55) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429443 0.84 CHRM2 (0.48) CHRM2CHRM1CHRM3CHRM5CHRM4

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
EP-4100410-B1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES INC (US) 2026-04-22 EP claimed
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 CHRM2 2/4885CHRM1 5/4885CHRM3 4/4885

“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.