SCHEMBL5220028

SCHEMBL5220028

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 1.00
KCNH2 Q12809 2/20 0.75
EPHX2 P34913 1/20 0.47
OPRD1 P41143 1/20 0.47
NAMPT P43490 1/20 0.44
PTGS2 P35354 1/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL14409487 1.00 HRH3 (1.00) HRH3KCNH2EPHX2OPRD1NAMPT
SCHEMBL5215701 0.99 HRH3 (0.98) HRH3KCNH2EPHX2OPRD1NAMPT
SCHEMBL14409427 0.99 HRH3 (0.98) HRH3KCNH2EPHX2OPRD1NAMPT
SCHEMBL14409320 0.88 HRH3 (0.78) HRH3KCNH2OPRD1NAMPTKMT2A
SCHEMBL5223516 0.88 HRH3 (0.78) HRH3KCNH2OPRD1NAMPTKMT2A
SCHEMBL5220121 0.88 HRH3 (0.78) HRH3KCNH2OPRD1PTGS2KMT2A
SCHEMBL5220127 0.88 HRH3 (0.78) HRH3KCNH2OPRD1PTGS2KMT2A
SCHEMBL5220130 0.88 HRH3 (0.78) HRH3KCNH2OPRD1PTGS2KMT2A
SCHEMBL5222619 0.87 HRH3 (0.76) HRH3KCNH2OPRD1PTGS2KMT2A
SCHEMBL5222601 0.87 HRH3 (0.76) HRH3KCNH2OPRD1PTGS2KMT2A

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 294/4885EPHX2 1056/4885

“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.