SCHEMBL2736717

SCHEMBL2736717

CCCCn1cc(-c2cc(Cl)ccc2Cl)cc(NC(=O)OCc2ccccc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.46
SCD O00767 3/20 0.42
CASP3 P42574 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CTRC Q99895 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KAT2B Q92831 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CHRM3 P20309 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL2760212 0.88 L3MBTL1 (0.47) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL2736727 0.81 CNR2 (0.56) SMN1; SMN2MEN1KMT2ACNR2
SCHEMBL2736731 0.72 CNR2 (0.50) MEN1KMT2ACNR2
SCHEMBL2736728 0.72 CNR2 (0.59) NPC1MEN1KMT2ACNR2
SCHEMBL216884 0.71 CNR2 (0.71) ELANENPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL1131165 0.69 CASP3 (0.61) CASP3NPC1RAB9AMEN1KMT2A
SCHEMBL3786368 0.69 MEN1 (0.59) CASP3NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL1095126 0.69 CASP3 (0.58) CASP3NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL2736889 0.69 PTGER4 (0.44) NPC1RAB9AMEN1KMT2ACNR2
SCHEMBL2736882 0.69 LMNA (0.57) NPC1RAB9ASMN1; SMN2MEN1KMT2A

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 5 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-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-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

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 ELANE 1292/4885SCD 2296/4885CASP3 2001/4885
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter CNR2, CNR1, NPY2R ELANE 4607/4885SCD 3687/4885CASP3 3371/4885
US-20080312292-A1 Antipruritics CNR1, CNR2, OPRL1 ELANE 512/4885SCD 302/4885CASP3 1721/4885

“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.