SCHEMBL4770280

SCHEMBL4770280

CN(c1cccnc1)c1cc[c]cn1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.40
SYK P43405 1/20 0.37
MAP3K8 P41279 1/20 0.34
CHRNB2 P17787 5/20 0.34
CHRNA4 P43681 5/20 0.34
NOTUM Q6P988 1/20 0.34
GRM5 P41594 5/20 0.34
CHRNA7 P36544 1/20 0.33
FYN P06241 1/20 0.32

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
SCHEMBL4777759 0.80 CHRM5 (0.42)
SCHEMBL13443083 0.77 KCNA5 (0.47) KCNA5SYKCHRNB2CHRNA4NOTUM
SCHEMBL3409401 0.75 KCNA5 (0.49) KCNA5CHRNB2CHRNA4GRM5CHRNA7
SCHEMBL4777939 0.73 CYP2D6 (0.43)
Hydrochloric Acid SCHEMBL4024971 0.73 KCNA5 (0.47) KCNA5CHRNB2CHRNA4GRM5CHRNA7
SCHEMBL27549059 0.72 KCNA5 (0.51) KCNA5CHRNB2CHRNA4NOTUMGRM5
SCHEMBL5075470 0.70 KCNA5 (0.50) KCNA5CHRNB2CHRNA4NOTUMGRM5
SCHEMBL5035544 0.70 KCNA5 (0.47) KCNA5SYKCHRNB2CHRNA4NOTUM
SCHEMBL182698 0.69
SCHEMBL2128199 0.68 CYP2A6 (0.47) KCNA5SYKCHRNB2CHRNA4NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP claimed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US claimed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO claimed
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO 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-20070265256-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A KCNA5 1686/4885SYK 3193/4885MAP3K8 2313/4885

“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.