SCHEMBL30345666

SCHEMBL30345666

C[C@@H]1CN(c2nc3ccc(F)cc3o2)[C@@H](C)CN1C(=O)OC1CC2(C1)CN(Cc1ccccc1)C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 7/20 0.42
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 2/20 0.38
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRB2 P47870 2/20 0.37
GABRA4 P48169 2/20 0.37
GABRE P78334 2/20 0.37
GABRA6 Q16445 2/20 0.37
GABRG1 Q8N1C3 2/20 0.37
GABRG3 Q99928 2/20 0.37
GABRQ Q9UN88 2/20 0.37
DAGLA Q9Y4D2 1/20 0.36

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
SCHEMBL26429735 1.00 NAAA (0.42) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL26429731 0.94 S1PR1 (0.38) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL34463948 0.94 S1PR1 (0.38) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL30345627 0.90 PPARD (0.37) NAAAS1PR1S1PR3MGLL
SCHEMBL26429712 0.90 PPARD (0.37) NAAAS1PR1S1PR3MGLL
SCHEMBL23744631 0.89 NAAA (0.46) NAAAKCNH2MCHR1CHRM4
SCHEMBL30345506 0.86 NAAA (0.45) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL26429732 0.86 NAAA (0.45) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL30345664 0.86 NAAA (0.45) NAAAS1PR1S1PR3GABRPGABRD
SCHEMBL26429733 0.86 NAAA (0.45) NAAAS1PR1S1PR3GABRPGABRD

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 NAAA 1419/4885S1PR1 427/4885S1PR3 450/4885

“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.