SCHEMBL5213329

SCHEMBL5213329

CC(C)c1cc(Nc2cccc(Cl)c2)ncc1C(=O)N1CCN(C)CC1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.62
CNR1 P21554 4/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47
CYP1A2 P05177 1/20 0.45
LMNA P02545 2/20 0.45
KMT2A Q03164 1/20 0.45
TP53 P04637 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 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
SCHEMBL5215525 0.91 CNR2 (0.63) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL5212172 0.89 CNR2 (0.68) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL5214047 0.89 CNR2 (0.58) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL14381004 0.88 CNR2 (0.56) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL5215693 0.84 CNR2 (0.59) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL4648950 0.82 CNR2 (0.72) CNR2LMNAKMT2A
SCHEMBL5213596 0.82 CNR2 (0.61) CNR2
SCHEMBL5212774 0.82 CNR2 (0.61) CNR2
SCHEMBL5212777 0.82 CNR2 (0.61) CNR2
SCHEMBL14381248 0.79 CNR2 (0.57) CNR2CNR1KMT2AALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565442-B1 PYRIDINE DERIVATIVES AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2007-11-14 EP claimed
EP-1565442-B1 PYRIDINE DERIVATIVES AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2007-11-14 EP disclosed
US-20060240048-A1 Pyridine derivatives as cb2 receptor modulators GLAXO GROUP LIMITED (GB) 2006-10-26 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-20060240048-A1 Pyridine derivatives as cb2 receptor modulators CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885CYP3A4 1047/4885

“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.