SCHEMBL2736877

SCHEMBL2736877

CCCCn1cc(-c2ccc(C(F)(F)F)cc2)cc(C(=O)NCc2ccccc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.53
CNR1 P21554 7/20 0.53
MTTP P55157 3/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
BRD4 O60885 2/20 0.45
PDE10A Q9Y233 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
SCHEMBL2736879 0.91 NPC1 (0.48) CNR2CNR1MTTPNPC1RAB9A
SCHEMBL2736795 0.91 CNR2 (0.54) CNR2CNR1RAB9ABRD4PDE10A
SCHEMBL2736873 0.91 CNR2 (0.52) CNR2CNR1
SCHEMBL2736878 0.91 PDE4A (0.55) CNR2CNR1
SCHEMBL250298 0.90 CNR2 (0.61) CNR2CNR1BRD4PDE10A
SCHEMBL2736810 0.89 CNR2 (0.56) CNR2CNR1BRD4PDE10A
SCHEMBL2736805 0.88 CNR2 (0.58) CNR2CNR1BRD4PDE10A
SCHEMBL2736850 0.88 CNR2 (0.60) CNR2CNR1BRD4PDE10A
SCHEMBL2736869 0.86 CNR2 (0.52) CNR2CNR1BRD4PDE10A
SCHEMBL2736892 0.85 CNR2 (0.54) CNR2CNR1NPC1RAB9ABRD4

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 CNR2 1/4885CNR1 2/4885MTTP 3720/4885

“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.