SCHEMBL20206870

SCHEMBL20206870

CCCC1CNCCN1C(=O)c1cc(N)nc(-c2cnn3ccc(-c4ccccc4)nc23)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CAMKK1 Q8N5S9 1/20 0.40
CAMKK2 Q96RR4 1/20 0.40
CAMK2D Q13557 12/20 0.38
PIK3CD O00329 1/20 0.38
CA1 P00915 4/20 0.37
CA2 P00918 4/20 0.37
CA4 P22748 4/20 0.37
CA9 Q16790 4/20 0.37
CYBB P04839 1/20 0.35
KCNH2 Q12809 2/20 0.35

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
SCHEMBL20207128 0.89 CAMK2D (0.50) CAMK2DKCNH2
SCHEMBL20186428 0.79 CAMKK1 (0.45) CAMKK1CAMKK2CAMK2DPIK3CDCYBB
SCHEMBL20186323 0.79 CAMKK1 (0.45) CAMKK1CAMKK2CAMK2DPIK3CDCYBB
SCHEMBL20186107 0.74 CAMKK1 (0.47) CAMKK1CAMKK2CAMK2DPIK3CDKCNH2
SCHEMBL20186103 0.74 CAMKK1 (0.47) CAMKK1CAMKK2CAMK2DPIK3CDKCNH2
SCHEMBL20186087 0.73 CAMKK1 (0.50) CAMKK1CAMKK2CAMK2DPIK3CD
SCHEMBL20186125 0.73 CAMKK1 (0.48) CAMKK1CAMKK2CAMK2DPIK3CDKCNH2
SCHEMBL20186086 0.73 CAMKK1 (0.50) CAMKK1CAMKK2CAMK2DPIK3CD
SCHEMBL20186122 0.73 CAMKK1 (0.48) CAMKK1CAMKK2CAMK2DPIK3CDKCNH2
SCHEMBL20186261 0.72 CAMKK1 (0.48) CAMKK1CAMKK2CAMK2DPIK3CD

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-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-05-31 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-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS CAMK1, CAMKK1, CAMK1D CAMKK1 2/4885CAMKK2 8/4885CAMK2D 6/4885

“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.