SCHEMBL863554

SCHEMBL863554

CC(Nc1ncnc2cccnc12)c1cc2cccc(Cl)c2nc1NCCN1CCNC1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.49
PIK3R2 O00459 11/20 0.49
PIK3CG P48736 3/20 0.43
IRAK1 P51617 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 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
SCHEMBL863553 1.00 PIK3CD (0.49) PIK3CDPIK3R2PIK3CGIRAK1IRAK4
SCHEMBL865448 0.88 PIK3CD (0.43) PIK3CDPIK3R2PIK3CGIRAK1IRAK4
SCHEMBL865449 0.88 PIK3CD (0.43) PIK3CDPIK3R2PIK3CGIRAK1IRAK4
SCHEMBL863618 0.84 CCR4 (0.40) PIK3CDIRAK1IRAK4
SCHEMBL863619 0.84 CCR4 (0.40) PIK3CDIRAK1IRAK4
SCHEMBL865200 0.83 IRAK1 (0.39) PIK3CDPIK3R2PIK3CGIRAK1IRAK4
SCHEMBL865201 0.83 IRAK1 (0.39) PIK3CDPIK3R2PIK3CGIRAK1IRAK4
SCHEMBL865373 0.82 IRAK1 (0.39) PIK3CDPIK3R2IRAK1IRAK4ADORA2A
SCHEMBL865372 0.82 IRAK1 (0.39) PIK3CDPIK3R2IRAK1IRAK4ADORA2A
SCHEMBL863742 0.80 PIK3CD (0.41) PIK3CDPIK3R2PIK3CGIRAK1IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2396315-B1 QUINOLINE DERIVATIVES AS PI3K KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-08-31 EP disclosed
US-8513284-B2 Fused pyridine and pyrazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2013-08-20 US disclosed
US-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors UCB PHARMA S.A. (BE) 2012-03-29 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-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors PDPK1, PDXK, PIK3CA PIK3CD 14/4885PIK3R2 131/4885PIK3CG 21/4885

“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.