SCHEMBL1193891

SCHEMBL1193891

O=CCCCNC(=O)C1CCc2ccccc2C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.54
GBA1 P04062 1/20 0.53
GHSR Q92847 1/20 0.47
PLD2 O14939 1/20 0.45
PLD1 Q13393 1/20 0.45
P2RX7 Q99572 1/20 0.44
NAMPT P43490 1/20 0.43
MTNR1A P48039 3/20 0.43
MTNR1B P49286 3/20 0.43
F2 P00734 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
EPHX2 P34913 1/20 0.40
FAAH O00519 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1193938 0.90 NAMPT (0.45) NPY5RGBA1P2RX7NAMPTMTNR1A
SCHEMBL22170856 0.82 NPY5R (0.61) NPY5RGBA1GHSRPLD2PLD1
SCHEMBL17551505 0.81 NPY5R (0.59) NPY5RGBA1GHSRPLD2PLD1
SCHEMBL9083616 0.78 GRIN2B (0.56) NPY5RMEN1KMT2A
SCHEMBL1193950 0.76 GBA1 (0.53) NPY5RGBA1GHSRPLD2PLD1
SCHEMBL1193687 0.74 MAPT (0.48) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL366547 0.74 P2RX7 (0.55) NPY5RGBA1GHSRP2RX7MTNR1A
SCHEMBL12190609 0.73 NPY5R (0.45) NPY5RGBA1GHSRPLD2PLD1
SCHEMBL13722291 0.73 NPY5R (0.49) NPY5RGBA1GHSRPLD2PLD1
SCHEMBL9568092 0.73 GHSR (0.49) NPY5RGBA1GHSRPLD2PLD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110046153-A1 Medicaments MOTAC NEUROSCIENCE LIMITED (GB) 2011-02-24 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-20110046153-A1 Medicaments MTNR1A, SIGMAR1, OPRK1 NPY5R 630/4885GBA1 384/4885GHSR 133/4885

“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.