SCHEMBL4909221

SCHEMBL4909221

OCc1ccc(Nc2cccc(Cl)c2)nc1C1CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 2/20 0.44
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
KDR P35968 5/20 0.42
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR2 P34972 1/20 0.40
EGFR P00533 3/20 0.40
IGF1R P08069 2/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CBLB Q13191 2/20 0.39
FADS1 O60427 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
SCHEMBL4648713 0.81 CNR2 (0.54) KDRLMNACNR2PIM1
SCHEMBL4896897 0.81 GRM5 (0.49) CNR2IGF1RJAK2PRKCQTYRO3
SCHEMBL4649605 0.77 CNR2 (0.56) ROCK1HTR3EHTR3BHTR3AHTR3D
SCHEMBL4650498 0.72 CNR2 (0.70) CNR2
SCHEMBL31172717 0.70 CBLB (0.36) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL14026110 0.69 CNR2 (0.55) CNR2IGF1RPRKCQ
SCHEMBL14065126 0.69 CNR2 (0.42) KDRCNR2MAP4K4
SCHEMBL4649611 0.68 CNR2 (0.54) KDRCNR2PRKCQ
SCHEMBL4187431 0.68 KDM4E (0.44) ROCK1HTR3EHTR3BHTR3AHTR3D
SCHEMBL4890203 0.67 GRM5 (0.47) CNR2IGF1RJAK2PRKCQ

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 1 patent. 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

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 ROCK1 4005/4885HTR3E 266/4885HTR3B 172/4885

“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.