SCHEMBL2737037

SCHEMBL2737037

CCCCn1c(C)c(C)cc(NC(=O)c2ccccc2Br)c1=O

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.81
CNR1 P21554 1/20 0.54
F2R P25116 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.46
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALOX15 P16050 1/20 0.45
CASP1 P29466 1/20 0.45
BRCA1 P38398 1/20 0.45
CASP7 P55210 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
NPSR1 Q6W5P4 1/20 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
SCHEMBL2737041 0.86 CNR2 (0.77) CNR2CNR1ALDH1A1KMT2AMEN1
SCHEMBL2737040 0.86 CNR2 (0.80) CNR2CNR1ALDH1A1KMT2AMEN1
SCHEMBL2737045 0.85 CNR2 (0.83) CNR2CNR1ALDH1A1KMT2AGAA
SCHEMBL218313 0.85 CNR2 (0.67) CNR2CNR1ALDH1A1KMT2AHTT
SCHEMBL2737030 0.85 CNR2 (0.84) CNR2CNR1F2RALDH1A1KMT2A
SCHEMBL2737042 0.84 CNR2 (0.77) CNR2CNR1ALDH1A1KMT2AGAA
SCHEMBL2737024 0.84 CNR2 (0.77) CNR2CNR1F2RALDH1A1KMT2A
SCHEMBL2737046 0.82 CNR2 (0.77) CNR2CNR1ALDH1A1KMT2AMEN1
SCHEMBL5518652 0.80 CNR2 (0.71) CNR2CNR1KMT2AMEN1NPC1
SCHEMBL2737026 0.79 CNR2 (0.69) CNR2CNR1ALDH1A1KMT2AKDM4E

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 2/4885F2R 415/4885

“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.