SCHEMBL863707

SCHEMBL863707

CNc1ncnc(NC(C)c2cc3cccc(Cl)c3nc2NCC2(O)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.38
DRD2 P14416 1/20 0.33
AURKA O14965 1/20 0.32
RPS6KB1 P23443 1/20 0.32
AURKB Q96GD4 1/20 0.32
KRAS P01116 2/20 0.31
EGFR P00533 2/20 0.31
ACACB O00763 1/20 0.31
SOS1 Q07889 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL863706 1.00 PIK3CD (0.38) PIK3CDDRD2AURKARPS6KB1AURKB
SCHEMBL865367 0.91 PIK3CD (0.43) PIK3CDDRD2AURKARPS6KB1AURKB
SCHEMBL865366 0.91 PIK3CD (0.43) PIK3CDDRD2AURKARPS6KB1AURKB
SCHEMBL864075 0.84 PIK3CD (0.41) PIK3CDAURKARPS6KB1AURKBKRAS
SCHEMBL864074 0.84 PIK3CD (0.41) PIK3CDAURKARPS6KB1AURKBKRAS
SCHEMBL863784 0.83 PIK3CD (0.38) PIK3CDAURKARPS6KB1AURKBEGFR
SCHEMBL863783 0.83 PIK3CD (0.38) PIK3CDAURKARPS6KB1AURKBEGFR
SCHEMBL863412 0.82 PIK3CD (0.47) PIK3CDDRD2AURKARPS6KB1AURKB
SCHEMBL863413 0.82 PIK3CD (0.47) PIK3CDDRD2AURKARPS6KB1AURKB
SCHEMBL864066 0.82 PIK3CD (0.39) PIK3CDDRD2

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 14/4885DRD2 3278/4885AURKA 284/4885

“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.