SCHEMBL2736893

SCHEMBL2736893

CCCCOc1ccc(-c2cc(C(=O)NCCc3ccccc3)c(=O)n(CCCC)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 4/20 0.53
MAPT P10636 2/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
LMNA P02545 4/20 0.52
CNR2 P34972 4/20 0.52
CNR1 P21554 3/20 0.51
HTT P42858 2/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48
GAA P10253 2/20 0.46
ADORA2B P29275 1/20 0.44
TAAR1 Q96RJ0 1/20 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
SCHEMBL2736892 0.90 CNR2 (0.54) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736853 0.89 LMNA (0.57) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736807 0.89 CNR2 (0.55) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736814 0.89 CNR2 (0.53) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736794 0.87 NPC1 (0.52) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736878 0.86 PDE4A (0.55) MEN1KMT2ASMN1; SMN2LMNACNR2
SCHEMBL2736828 0.85 LMNA (0.57) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736848 0.84 LMNA (0.55) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736862 0.83 CNR2 (0.52) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2736843 0.83 CNR2 (0.53) MEN1KMT2ARAB9ASMN1; SMN2MAPT

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 MEN1 3159/4885KMT2A 2963/4885NPC1 4500/4885

“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.