SCHEMBL23744744

SCHEMBL23744744

FC(F)(F)c1cnc(N2CC3CC(C2)N3)nc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 7/20 0.49
CHRNA3 P32297 7/20 0.49
ACACB O00763 1/20 0.41
ROCK2 O75116 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
CHRM4 P08173 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CHRM2 P08172 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
Hydrochloric Acid SCHEMBL26126547 0.98 CHRNB4 (0.48) CHRNB4CHRNA3ACACBROCK2CHRNB2
Hydrochloric Acid SCHEMBL25308897 0.98 CHRNB4 (0.48) CHRNB4CHRNA3ACACBROCK2CHRNB2
SCHEMBL24962267 0.92 CHRNB2 (0.43) CHRNB4CHRNA3ACACBROCK2CHRNB2
SCHEMBL26576127 0.92 CHRNB2 (0.43) CHRNB4CHRNA3ACACBROCK2CHRNB2
Hydrochloric Acid SCHEMBL25309900 0.90 CHRNB2 (0.42) CHRNB4CHRNA3ACACBROCK2CHRNB2
Hydrochloric Acid SCHEMBL26125668 0.90 CHRNB2 (0.42) CHRNB4CHRNA3ACACBROCK2CHRNB2
SCHEMBL26087034 0.87 CHRNB4 (0.40) CHRNB4CHRNA3ACACBCHRM4HDAC3
SCHEMBL18825871 0.81 EIF2AK4 (0.44) ACACBCHRM4CHRM2
SCHEMBL23727544 0.81 EIF2AK4 (0.44) ACACBCHRM4CHRM2
Hydrochloric Acid SCHEMBL29731387 0.80 EIF2AK4 (0.43) ACACBCHRM4CHRM2

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 7 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 disclosed
WO-2023185073-A1 PARP7 INHIBITOR AND USE THEREOF 诺沃斯达药业(上海)有限公司 2023-10-05 WO disclosed
WO-2023185073-A1 PARP7 INHIBITOR AND USE THEREOF 诺沃斯达药业(上海)有限公司 2023-10-05 WO 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
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 CHRNB4 11/4885CHRNA3 12/4885ACACB 2959/4885

“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.