SCHEMBL12464451

SCHEMBL12464451

CCNC1CCN(CC2CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
CHRM5 P08912 1/20 0.40
ADRA2C P18825 1/20 0.40
KCNH2 Q12809 1/20 0.36
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33

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
SCHEMBL5554376 0.84 ACHE (0.41) ACHECHRM5ADRA2C
SCHEMBL19723150 0.82 KDM4E (0.37) ACHECHRM5ADRA2CKCNH2
SCHEMBL2760188 0.80 SMN1; SMN2 (0.42) ACHEKCNH2
SCHEMBL2842528 0.78 ACHE (0.47) ACHECHRM5ADRA2C
SCHEMBL8728949 0.77 KCNH2 (0.38) ACHEKCNH2
SCHEMBL22878502 0.77 PABPC1 (0.46) KCNH2
SCHEMBL23023333 0.73 ACHE (0.47) ACHECHRM5ADRA2C
SCHEMBL8728946 0.73 CARM1 (0.37) KCNH2
SCHEMBL24673647 0.73 ROCK2 (0.39) ACHEKCNH2
SCHEMBL12395758 0.73 ACHE (0.42) ACHECHRM5ADRA2C

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-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2011-07-28 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-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B ACHE 4115/4885CHRM5 4550/4885ADRA2C 2840/4885

“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.