SCHEMBL23744152

SCHEMBL23744152

C#Cc1cnc(N2C[C@@H](C)N[C@@H](C)C2)nc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.43
BCL6 P41182 2/20 0.35
NCOR2 Q9Y618 1/20 0.35
AURKA O14965 1/20 0.33
SCN9A Q15858 1/20 0.32
HDAC1 Q13547 1/20 0.31
PRMT5 O14744 1/20 0.31
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
FGFR1 P11362 1/20 0.31
ACACB O00763 2/20 0.30
KHK P50053 1/20 0.30
HRH4 Q9H3N8 1/20 0.30

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
SCHEMBL18848401 0.83 PTPN11 (0.40) PTPN11JAK2JAK3
SCHEMBL18825818 0.83 PTPN11 (0.40) PTPN11JAK2JAK3
SCHEMBL20456782 0.80 CHRNB2 (0.43)
SCHEMBL23744157 0.79 PTPN11 (0.44) PTPN11BCL6NCOR2AURKASCN9A
SCHEMBL23744047 0.77 PTPN11 (0.51) PTPN11BCL6NCOR2SCN9AACACB
SCHEMBL24945764 0.77 PTPN11 (0.43) PTPN11BCL6NCOR2AURKASCN9A
SCHEMBL23744086 0.77 PTPN11 (0.43) PTPN11BCL6NCOR2AURKASCN9A
SCHEMBL15725788 0.77 PTPN11 (0.49) PTPN11BCL6NCOR2AURKASCN9A
SCHEMBL23744751 0.77 PTPN11 (0.51) PTPN11BCL6NCOR2SCN9AACACB
SCHEMBL23744770 0.77 PTPN11 (0.43) PTPN11BCL6NCOR2SCN9A

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 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 PTPN11 1801/4885BCL6 4736/4885NCOR2 1909/4885

“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.