SCHEMBL2736786

SCHEMBL2736786

CCCCn1cc(-c2cc3ccccc3o2)cc(C(=O)NCCc2ccccc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
NPC1 O15118 2/20 0.54
CNR2 P34972 3/20 0.49
CNR1 P21554 2/20 0.49
LMNA P02545 4/20 0.46
HTT P42858 2/20 0.46
MAPK1 P28482 2/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
KDM4E B2RXH2 2/20 0.43
AKR1B10 O60218 1/20 0.43
KMT2A Q03164 3/20 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
SCHEMBL2736785 0.91 MAOB (0.53) L3MBTL1NPC1CNR2CNR1LMNA
SCHEMBL2736812 0.84 CNR2 (0.52) L3MBTL1NPC1CNR2CNR1LMNA
SCHEMBL2736787 0.84 MAOB (0.45) L3MBTL1CNR2CNR1HTTPOLB
SCHEMBL2736789 0.84 KDM4E (0.62) CNR2CNR1HTTPOLBSMN1; SMN2
SCHEMBL2736853 0.81 LMNA (0.57) NPC1CNR2CNR1LMNAHTT
SCHEMBL2736807 0.81 CNR2 (0.55) NPC1CNR2CNR1LMNAHTT
SCHEMBL2736814 0.81 CNR2 (0.53) NPC1CNR2CNR1LMNAHTT
SCHEMBL2736843 0.81 CNR2 (0.53) CNR2CNR1LMNAHTTMAPK1
SCHEMBL2736791 0.80 CNR2 (0.49) L3MBTL1NPC1CNR2CNR1LMNA
SCHEMBL2736848 0.80 LMNA (0.55) NPC1CNR2CNR1LMNAHTT

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 L3MBTL1 4225/4885NPC1 4500/4885CNR2 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.