SCHEMBL2736794

SCHEMBL2736794

CCCCn1cc(-c2ccc(C(C)(C)C)cc2)cc(C(=O)NCCc2ccccc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
CNR2 P34972 4/20 0.52
ESRRG P62508 6/20 0.51
CNR1 P21554 3/20 0.51
LMNA P02545 3/20 0.48
HTT P42858 2/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.46
ESRRB O95718 3/20 0.44

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
SCHEMBL2736878 0.92 PDE4A (0.55) CNR2CNR1LMNAHTTPOLB
SCHEMBL2736795 0.90 CNR2 (0.54) RAB9ACNR2CNR1LMNAPOLB
SCHEMBL2736853 0.89 LMNA (0.57) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736807 0.89 CNR2 (0.55) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736814 0.89 CNR2 (0.53) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736893 0.87 MEN1 (0.58) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736874 0.84 PDE4A (0.54) CNR2CNR1LMNAHTTPOLB
SCHEMBL2736848 0.84 LMNA (0.55) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736862 0.83 CNR2 (0.52) NPC1RAB9ACNR2CNR1LMNA
SCHEMBL2736843 0.83 CNR2 (0.53) RAB9ACNR2CNR1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088924-B2 Pyridone derivatives having a binding activity to the cannabinoid type 2 receptor SHIONOGI & CO., LTD. (JP) 2012-01-03 US disclosed
US-8088924-B2 Pyridone derivatives having a binding activity to the cannabinoid type 2 receptor SHIONOGI & CO., LTD. (JP) 2012-01-03 US disclosed
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter TADA YUKIO 2010-04-01 US disclosed
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter TADA YUKIO 2010-04-01 US disclosed
US-7652141-B2 Immunosuppressants, analgesics, antiinflammatory agents SHIONOGI & CO., LTD. (JP) 2010-01-26 US disclosed
US-7652141-B2 Immunosuppressants, analgesics, antiinflammatory agents SHIONOGI & CO., LTD. (JP) 2010-01-26 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-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter CNR2, CNR1, NPY2R NPC1 4500/4885RAB9A 2871/4885CNR2 1/4885

“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.