SCHEMBL5218900

SCHEMBL5218900

O=C(/C=C/N1CCC[C@H]1CN1CCCC1)c1ccoc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.41
MAPT P10636 3/20 0.39
GPR52 Q9Y2T5 1/20 0.39
KCNH2 Q12809 2/20 0.39
RECQL P46063 1/20 0.36
CCR5 P51681 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36

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 0.82 HRH3 (0.44) HRH3KCNH2KDM4EALDH1A1
SCHEMBL5221259 0.82 HRH3 (0.55) HRH3MAPTKCNH2ALDH1A1CYP1A2
SCHEMBL5216163 0.82 NPC1 (0.46) HRH3MAPTKCNH2KDM4EALDH1A1
SCHEMBL5222144 0.82 NPC1 (0.46) HRH3MAPTKCNH2KDM4EALDH1A1
SCHEMBL5223808 0.81 ALDH1A1 (0.45) HRH3MAPTKCNH2KDM4EMEN1
SCHEMBL5222690 0.81 HRH3 (0.44) HRH3KCNH2
SCHEMBL5958398 0.81 HRH3 (0.54) HRH3MAPTKCNH2ALDH1A1
SCHEMBL5225214 0.80 HRH3 (0.44) HRH3GPR52KCNH2ALDH1A1
SCHEMBL5958271 0.80 HRH3 (0.40) HRH3GPR52KCNH2
SCHEMBL5218209 0.80 HRH3 (0.56) HRH3MAPTGPR52KCNH2MEN1

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 1/4885MAPT 3405/4885GPR52 65/4885

“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.