SCHEMBL4649753

SCHEMBL4649753

Clc1ccc(Nc2ccc(CNCC3CCOCC3)c(C3CC3)n2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.53
CYP1A2 P05177 3/20 0.47
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
CYP2D6 P10635 4/20 0.38
CYP2C9 P11712 4/20 0.38
CYP2C19 P33261 4/20 0.38
KDR P35968 1/20 0.37
CCNT1 O60563 1/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
CCNK O75909 1/20 0.36
CDK9 P50750 1/20 0.36
CCR2 P41597 1/20 0.35

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
SCHEMBL4648713 0.87 CNR2 (0.54) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL14065126 0.83 CNR2 (0.42) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4649002 0.83 CNR2 (0.44) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4649611 0.82 CNR2 (0.54) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4648729 0.82 CNR2 (0.69) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL30730223 0.71 PRMT5 (0.71) CYP1A2PRMT5WDR77CYP2D6CYP2C9
SCHEMBL4650498 0.69 CNR2 (0.70) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4932814 0.69 CNR2 (1.00) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL14005882 0.69 CNR2 (0.69) CNR2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4923994 0.67 CNR2 (0.70) CNR2CYP1A2CYP2D6CYP2C9CYP2C19

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-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
EP-1718613-B1 PYRIDINE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2008-09-03 EP disclosed
EP-1718613-B1 PYRIDINE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2008-09-03 EP 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-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators CNR2, CNR1, TRPV1 CNR2 1/4885CYP1A2 306/4885PRMT5 4098/4885

“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.