SCHEMBL5218173

SCHEMBL5218173

O=C(/C=C/N1CCC[C@H]1CN1CCCC1)c1ccccc1Br

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.43
KCNH2 Q12809 3/20 0.43
KMT2A Q03164 1/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
SLC6A1 P30531 3/20 0.41
L3MBTL3 Q96JM7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL5216163 0.81 NPC1 (0.46) HRH3KCNH2LMNAMAPTL3MBTL3
SCHEMBL5222144 0.81 NPC1 (0.46) HRH3KCNH2LMNAMAPTL3MBTL3
SCHEMBL6623820 0.80 HRH3 (0.38) HRH3KCNH2LMNAMAPT
SCHEMBL5225227 0.80 HRH3 (0.38) HRH3KCNH2LMNAMAPT
SCHEMBL5223808 0.80 ALDH1A1 (0.45) HRH3KCNH2KMT2ALMNAMAPT
SCHEMBL5221464 0.80 ALDH1A1 (0.47) HRH3KMT2ALMNAMAPTL3MBTL3
SCHEMBL5218209 0.79 HRH3 (0.56) HRH3KCNH2KMT2AMAPTALDH1A1
SCHEMBL5218303 0.79 ALDH1A1 (0.49) KMT2ALMNAMAPTL3MBTL3L3MBTL1
SCHEMBL5221237 0.79 NPC1 (0.46) HRH3KCNH2LMNAMAPTL3MBTL3
SCHEMBL5225214 0.77 HRH3 (0.44) HRH3KCNH2L3MBTL1ALDH1A1

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-1474419-B1 AMIDES OF AMINOALKYL-SUBSTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES NOVO NORDISK AS (DK) 2007-09-05 EP disclosed
US-7101898-B2 For therapy of allergic rhinitis, ulcer or anorexia, diabetes, Alzheimer's disease, narcolepsy or attention deficit disorder NOVO NORDISK A/S (DK) 2006-09-05 US disclosed
EP-1474419-A1 AMIDES OF AMINOALKYL-SUBSTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES NOVO NORDISK A/S (DK) 2004-11-10 EP disclosed
US-20030195190-A1 Amides of aminoalkyl-substituted azetidines, pyrrolidines, piperidines and azepanes HIGH POINT PHARMACEUTICALS, LLC 2003-10-16 US disclosed
WO-2003064411-A1 AMIDES OF AMINOALKYL-SUBSTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES NOVO NORDISK A/S (DK) 2003-08-07 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-20030195190-A1 Amides of aminoalkyl-substituted azetidines, pyrrolidines, piperidines and azepanes HRH3, HRH2, HRH4 HRH3 1/4885KCNH2 294/4885KMT2A 441/4885

“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.