SCHEMBL1877296

SCHEMBL1877296

Cc1cc(OCc2cc3cccc(Cc4ccccc4)c3nc2-c2ccccc2C)nc(N)n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.43
NUDT1 P36639 2/20 0.42
CD274 Q9NZQ7 1/20 0.37
HRH4 Q9H3N8 1/20 0.36
ADORA2A P29274 1/20 0.36
POLB P06746 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 0.81 PIK3CD (0.45) PIK3CDNUDT1ADORA2APOLB
SCHEMBL1886299 0.81 PIK3CD (0.40) PIK3CDNUDT1ADORA2APOLB
SCHEMBL1883779 0.80 PIK3CD (0.48) PIK3CDNUDT1
SCHEMBL1881538 0.80 NPC1 (0.42) PIK3CDNUDT1HRH4ADORA2APOLB
SCHEMBL1881330 0.80 PIK3CD (0.54) PIK3CDNUDT1
SCHEMBL1884555 0.79 PIK3CD (0.44) PIK3CDNUDT1HRH4ADORA2APOLB
SCHEMBL1875430 0.79 PIK3CD (0.46) PIK3CD
SCHEMBL1884713 0.78 PIK3CD (0.46) PIK3CDNUDT1
SCHEMBL1879719 0.78 PIK3CD (0.39) PIK3CDNUDT1ADORA2APOLB
SCHEMBL1883116 0.76 KDM4E (0.41) PIK3CDNUDT1ADORA2APOLB

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 8/4885NUDT1 1761/4885CD274 3130/4885

“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.