SCHEMBL3244786

SCHEMBL3244786

O=C(Nc1ccccn1)C1COCCN1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 1/20 0.47
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
PKM P14618 3/20 0.46
GAA P10253 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PIP5K1B O14986 1/20 0.41
PIP5K1C O60331 1/20 0.41
PIK3CA P42336 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK10 P53779 1/20 0.41
MAPK14 Q16539 1/20 0.41
PIP5K1A Q99755 1/20 0.41

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
SCHEMBL5754037 0.80 NPC1 (0.50) GRM1NPC1RAB9APKMGAA
SCHEMBL3331893 0.80 NPC1 (0.50) GRM1NPC1RAB9APKMGAA
SCHEMBL18953255 0.80 HPGD (0.42) SMN1; SMN2
SCHEMBL18953253 0.80 HPGD (0.42) SMN1; SMN2
SCHEMBL18953247 0.80 HPGD (0.42) GAAMEN1KMT2ASMN1; SMN2
SCHEMBL18953248 0.80 HPGD (0.42) GAAMEN1KMT2ASMN1; SMN2
SCHEMBL18953214 0.77 HPGD (0.40) MAPK8
SCHEMBL18953213 0.77 HPGD (0.40) MAPK8
SCHEMBL4977339 0.73 NPC1 (0.47) GRM1NPC1RAB9APKMGAA
SCHEMBL28151973 0.73 CD274 (0.44) PKMMEN1KMT2ASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3755684-B1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H LUNDBECK AS (DK) 2023-07-12 EP disclosed
US-20110312962-A1 NOVEL 2-MORPHOLINO-3-AMIDO-PYRIDINE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2011-12-22 US disclosed
WO-2010060955-A1 NOVEL 2-MORPHOLINO-3-AMIDO-PYRIDINE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2010-06-03 WO disclosed
WO-2010060955-A1 NOVEL 2-MORPHOLINO-3-AMIDO-PYRIDINE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2010-06-03 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-20110312962-A1 NOVEL 2-MORPHOLINO-3-AMIDO-PYRIDINE DERIVATIVES AND THEIR MEDICAL USE KCNA7, KCNQ1, KCNQ2 GRM1 664/4885NPC1 4001/4885RAB9A 2935/4885

“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.