SCHEMBL4650337

SCHEMBL4650337

CC(C)c1cc(Nc2cccc(Cl)c2)ncc1CN1CCSCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.50
EGFR P00533 3/20 0.41
PRKDC P78527 1/20 0.39
ERBB2 P04626 1/20 0.38
CYP2A13 Q16696 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
ERBB3 P21860 1/20 0.38

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
SCHEMBL4649778 0.91 CNR2 (0.53) CNR2EGFRPRKDCERBB2CHRNB4
SCHEMBL4648957 0.91 CNR2 (0.53) CNR2EGFRPRKDCERBB2CHRNB4
Hydrochloric Acid SCHEMBL4910087 0.90 CNR2 (0.52) CNR2EGFRPRKDCERBB2CHRNB4
SCHEMBL14006031 0.89 CNR2 (0.51) CNR2EGFRPRKDC
SCHEMBL14006008 0.88 CNR2 (0.50) CNR2EGFRPRKDCERBB2CHRNB4
Hydrochloric Acid SCHEMBL4689672 0.87 CNR2 (0.49) CNR2EGFRPRKDCERBB2CHRNB4
SCHEMBL14006020 0.84 CNR2 (0.46) CNR2CYP2A13
Hydrochloric Acid SCHEMBL4650301 0.83 CNR2 (0.45) CNR2CYP2A13
SCHEMBL4649706 0.79 CNR2 (0.61) CNR2EGFRERBB3
SCHEMBL14065242 0.78 PIK3CA (0.43) CNR2EGFRPRKDCERBB2

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 1/4885EGFR 818/4885PRKDC 4152/4885

“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.