SCHEMBL5218209

SCHEMBL5218209

O=C(/C=C/N1CCC[C@H]1CN1CCCC1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.56
KCNH2 Q12809 2/20 0.49
HPGD P15428 2/20 0.49
MAPK1 P28482 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
USP2 O75604 1/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
HSP90AA1 P07900 1/20 0.49
MAPT P10636 1/20 0.49
ALOX12 P18054 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
KDM2B Q8NHM5 3/20 0.46
GPR52 Q9Y2T5 1/20 0.42
MET P08581 1/20 0.42
ATR Q13535 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
SCHEMBL5220645 0.86 HRH3 (0.44) HRH3KCNH2ALDH1A1
SCHEMBL5221259 0.86 HRH3 (0.55) HRH3KCNH2NPC1ALDH1A1MAPT
SCHEMBL5216163 0.86 NPC1 (0.46) HRH3KCNH2HPGDNPC1USP2
SCHEMBL5222144 0.86 NPC1 (0.46) HRH3KCNH2HPGDNPC1USP2
SCHEMBL5223808 0.85 ALDH1A1 (0.45) HRH3KCNH2HPGDMEN1NPC1
SCHEMBL5958398 0.85 HRH3 (0.54) HRH3KCNH2ALDH1A1MAPTKDM2B
SCHEMBL5222690 0.85 HRH3 (0.44) HRH3KCNH2KDM2B
SCHEMBL5218192 0.83 HRH3 (0.52) HRH3NPC1ALDH1A1MAPTKDM2B
SCHEMBL5221237 0.83 NPC1 (0.46) HRH3KCNH2HPGDNPC1USP2
SCHEMBL5218926 0.83 HRH3 (0.57) HRH3KCNH2HPGDMEN1POLB

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 3 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
US-20030195190-A1 Amides of aminoalkyl-substituted azetidines, pyrrolidines, piperidines and azepanes HIGH POINT PHARMACEUTICALS, LLC 2003-10-16 US 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 294/4885HPGD 863/4885

“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.