SCHEMBL1880893

SCHEMBL1880893

Cc1cccc2cc(COc3ncnc4cnccc34)c(-c3ccccc3)nc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.42
PIK3CG P48736 1/20 0.35
EGFR P00533 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
DHODH Q02127 1/20 0.35
ALDH1A1 P00352 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
PDK1 Q15118 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL1884601 0.82 PIK3CD (0.47) PIK3CDPIK3CGDHODH
SCHEMBL4184462 0.79 PIK3CD (0.47) PIK3CDPIK3CG
SCHEMBL1887094 0.75 PIK3CD (0.45) PIK3CD
SCHEMBL12004063 0.72 TRPA1 (0.40) PIK3CD
SCHEMBL1877699 0.71 PIK3CD (0.45) PIK3CD
SCHEMBL17928702 0.70 PIK3CD (0.45) PIK3CDPIK3CG
SCHEMBL4178472 0.69 PIK3CD (0.49) PIK3CD
SCHEMBL10250951 0.69 PIK3CD (0.47) PIK3CDPIK3CG
SCHEMBL1879939 0.69 PIK3CD (0.45) PIK3CDALDH1A1
SCHEMBL1888178 0.69 PIK3CD (0.45) PIK3CD

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-8399483-B2 Quinoxaline and quinoline derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2013-03-19 US disclosed
US-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA, S.A. (BE) 2011-05-05 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-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS PDXK, PDPK1, PIKFYVE PIK3CD 8/4885PIK3CG 9/4885EGFR 4187/4885

“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.