SCHEMBL1887143

SCHEMBL1887143

Cc1nc(N)nc(O[C@@H](C)c2cc3cccc(C)c3nc2-c2ccccc2C)n1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.53
ATM Q13315 1/20 0.43
ADORA2A P29274 1/20 0.36
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
DHFR P00374 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1887147 1.00 PIK3CD (0.53) PIK3CDATMADORA2AMAPTMAPK1
SCHEMBL1882958 0.89 PIK3CD (0.46) PIK3CDATMADORA2AMAPK1DHFR
SCHEMBL1882961 0.89 PIK3CD (0.46) PIK3CDATMADORA2AMAPK1DHFR
SCHEMBL1877100 0.83 PIK3CD (0.41) PIK3CDATMADORA2AMAPTMAPK1
SCHEMBL1877108 0.83 PIK3CD (0.41) PIK3CDATMADORA2AMAPTMAPK1
SCHEMBL1882140 0.82 PIK3CD (0.40) PIK3CDATMRAB9A
SCHEMBL1882135 0.82 PIK3CD (0.40) PIK3CDATMRAB9A
SCHEMBL1882072 0.81 PIK3CD (0.39) PIK3CDATM
SCHEMBL1882069 0.81 PIK3CD (0.39) PIK3CDATM
SCHEMBL1881117 0.77 ATM (0.48) PIK3CDATMADORA2AMAPTMAPK1

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 8/4885ATM 545/4885ADORA2A 1938/4885

“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.