SCHEMBL1884683

SCHEMBL1884683

Cc1cc(OCc2cc3cccc(C)c3nc2-c2cccnc2)nc(N)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.40
CYP2A6 P11509 1/20 0.39
POLB P06746 2/20 0.37
NUDT1 P36639 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL1879939 0.89 PIK3CD (0.45) PIK3CDPOLBNUDT1
SCHEMBL1882523 0.82 PIK3CD (0.40) PIK3CDPOLBNUDT1MAPT
SCHEMBL1886844 0.79 PIK3CD (0.41) PIK3CDCYP2A6NUDT1MAPTMEN1
SCHEMBL1881538 0.78 NPC1 (0.42) PIK3CDPOLBNUDT1
SCHEMBL1877699 0.78 PIK3CD (0.45) PIK3CDNUDT1
SCHEMBL1878147 0.77 PIK3CD (0.39) PIK3CDPOLBNUDT1
SCHEMBL1883779 0.77 PIK3CD (0.48) PIK3CDNUDT1ATM
SCHEMBL1885076 0.77 PIK3CD (0.42) PIK3CDNUDT1ATM
SCHEMBL1881330 0.77 PIK3CD (0.54) PIK3CDNUDT1ATM
SCHEMBL1875430 0.76 PIK3CD (0.46) PIK3CDATM

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 8/4885CYP2A6 2275/4885POLB 1450/4885

“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.