SCHEMBL5216540

SCHEMBL5216540

O=C(C=Cc1ccc(C(F)(F)F)cc1)N1CCCC1CN1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 1.00
KCNH2 Q12809 3/20 1.00
OPRD1 P41143 1/20 0.64
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL14409596 1.00 HRH3 (1.00) HRH3KCNH2OPRD1KMT2ACYP1A2
SCHEMBL5218586 0.99 HRH3 (0.98) HRH3KCNH2OPRD1KMT2A
SCHEMBL14409481 0.99 HRH3 (0.98) HRH3KCNH2OPRD1KMT2A
SCHEMBL14409586 0.98 HRH3 (0.96) HRH3KCNH2OPRD1KMT2A
SCHEMBL5220599 0.98 HRH3 (0.96) HRH3KCNH2OPRD1KMT2A
SCHEMBL14409442 0.89 HRH3 (0.80) HRH3KCNH2OPRD1KMT2ACYP1A2
SCHEMBL5217787 0.89 HRH3 (0.80) HRH3KCNH2OPRD1KMT2ACYP1A2
SCHEMBL14409420 0.87 HRH3 (0.78) HRH3KCNH2OPRD1KMT2A
SCHEMBL5220654 0.87 HRH3 (0.78) HRH3KCNH2OPRD1KMT2A
SCHEMBL14409440 0.87 HRH3 (0.77) HRH3KCNH2OPRD1

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 294/4885OPRD1 60/4885

“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.