SCHEMBL2736728

SCHEMBL2736728

CCCCn1cc(-c2ccccc2Cl)cc(NC(=O)c2ccccc2C)c1=O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.59
LMNA P02545 1/20 0.47
ALDH1A1 P00352 2/20 0.43
CYP2C9 P11712 1/20 0.43
KCNMA1 Q12791 1/20 0.42
DHODH Q02127 1/20 0.41
CNR1 P21554 2/20 0.41
DCTPP1 Q9H773 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2736727 0.91 CNR2 (0.56) CNR2LMNAALDH1A1CYP2C9KCNMA1
SCHEMBL2760181 0.86 CNR2 (0.64) CNR2CYP2C9CNR1HPGDHTT
SCHEMBL2736726 0.83 CNR2 (0.62) CNR2LMNAALDH1A1DCTPP1KDM4E
SCHEMBL2736717 0.72 ELANE (0.46) CNR2MEN1NPC1KMT2A
SCHEMBL2760212 0.71 L3MBTL1 (0.47) LMNAALDH1A1CYP2C9CNR1KDM4E
SCHEMBL2736842 0.71 CNR2 (0.61) CNR2LMNAALDH1A1CNR1KDM4E
SCHEMBL2736781 0.70 BRD4 (0.55) CNR2LMNAALDH1A1KCNMA1KDM4E
SCHEMBL2737030 0.70 CNR2 (0.84) CNR2LMNAALDH1A1CNR1DCTPP1
SCHEMBL2736843 0.69 CNR2 (0.53) CNR2LMNACNR1HPGDHTT
SCHEMBL13164048 0.68 HPGD (0.74) LMNAALDH1A1CYP2C9KCNMA1DHODH

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 10 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
US-20080312292-A1 Antipruritics YASUI KIYOSHI 2008-12-18 US disclosed
US-20080312292-A1 Antipruritics YASUI KIYOSHI 2008-12-18 US disclosed
US-20070027144-A1 Novel use of cannabinoid receptor agonist SHIONOGI & CO., LTD. (JP) 2007-02-01 US disclosed
US-20070027144-A1 Novel use of cannabinoid receptor agonist SHIONOGI & CO., LTD. (JP) 2007-02-01 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 (3 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-20070027144-A1 Novel use of cannabinoid receptor agonist CNR2, CNR1, OPRM1 CNR2 1/4885LMNA 4495/4885ALDH1A1 2784/4885
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter CNR2, CNR1, NPY2R CNR2 1/4885LMNA 3511/4885ALDH1A1 3078/4885
US-20080312292-A1 Antipruritics CNR1, CNR2, OPRL1 CNR2 2/4885LMNA 4604/4885ALDH1A1 3580/4885

“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.