SCHEMBL14222467

SCHEMBL14222467

N[C@]12CCCC[C@H]1CNC2

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 9/20 0.38
SLC6A4 P31645 9/20 0.38
SLC6A3 Q01959 9/20 0.38
CYP1A1 P04798 6/20 0.38
CYP1A2 P05177 6/20 0.38
CYP2D6 P10635 6/20 0.38
CYP3A4 P08684 5/20 0.38
KCNH2 Q12809 4/20 0.38
CYP2C19 P33261 3/20 0.33
CYP2C9 P11712 2/20 0.33

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
SCHEMBL14139691 1.00 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3CYP1A1CYP1A2
SCHEMBL14224219 0.93
SCHEMBL2670113 0.93
SCHEMBL2670253 0.93
SCHEMBL2670079 0.84
SCHEMBL12855768 0.81 APLNR (0.31) SLC6A2SLC6A4SLC6A3CYP1A1CYP1A2
SCHEMBL8802845 0.74 APLNR (0.32)
SCHEMBL6429936 0.73 KDM4E (0.35)
SCHEMBL21613308 0.73
SCHEMBL18306055 0.73 KDM4E (0.35)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008041090-A1 MALANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONIST PYRIDINONES PFIZER LIMITED (GB) 2008-04-10 WO disclosed
US-20080085884-A1 Melanin Concentrating Hormone Receptor-1 Antagonist Pyridinones PFIZER INC 2008-04-10 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-20080085884-A1 Melanin Concentrating Hormone Receptor-1 Antagonist Pyridinones MCHR1, MCHR2, MC1R SLC6A2 343/4885SLC6A4 554/4885SLC6A3 383/4885

“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.