SCHEMBL23744650

SCHEMBL23744650

C[C@@H]1CN(c2nc3cc(F)ccc3s2)[C@@H](C)CN1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.38
NAAA Q02083 6/20 0.37
DYRK1A Q13627 1/20 0.37
USP30 Q70CQ3 2/20 0.36
ILK Q13418 1/20 0.36
PIM1 P11309 1/20 0.35
AHR P35869 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
PRKCI P41743 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL30345540 1.00 NPC1 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA
SCHEMBL23744490 0.90 NPC1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA
SCHEMBL30345371 0.90 NPC1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA
SCHEMBL23744089 0.85 PIM1 (0.36) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA
SCHEMBL30345654 0.85 PIM1 (0.36) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA
SCHEMBL23744657 0.82 RAB9A (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL10219137 0.78 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL10219141 0.78 PPARD (0.49) DYRK1A
SCHEMBL23744493 0.78 PPARD (0.49) DYRK1A
SCHEMBL23744375 0.77 NPC1 (0.48) NPC1RAB9ASMN1; SMN2ALDH1A1NAAA

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 NPC1 1236/4885RAB9A 3190/4885SMN1; SMN2 1135/4885

“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.