SCHEMBL864931

SCHEMBL864931

C[C@H](Nc1ncnn2cccc12)c1cc2cccc(Cl)c2nc1N

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 5/20 0.51
PIK3CD O00329 7/20 0.45
EGFR P00533 2/20 0.41
KDR P35968 2/20 0.41
AAK1 Q2M2I8 6/20 0.39
PIK3R2 O00459 2/20 0.36
PIK3R1 P27986 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 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
SCHEMBL864932 1.00 MAP4K4 (0.51) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864571 0.88 MAP4K4 (0.51) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864572 0.88 MAP4K4 (0.51) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864327 0.83 MAP4K4 (0.46) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864328 0.83 MAP4K4 (0.46) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864459 0.82 MAP4K4 (0.44) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL864458 0.82 MAP4K4 (0.44) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL14482952 0.81 MAP4K4 (0.42) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL14482960 0.81 MAP4K4 (0.42) MAP4K4PIK3CDEGFRKDRAAK1
SCHEMBL865004 0.77 MAP4K4 (0.39) MAP4K4PIK3CDPIK3R2PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAP4K4 34/4885PIK3CD 14/4885EGFR 3185/4885

“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.