SCHEMBL1877014

SCHEMBL1877014

Cc1cccc(-c2nc3c(C)cccc3cc2CBr)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.54
ATM Q13315 1/20 0.40
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
DPP4 P27487 1/20 0.37
RAB9A P51151 1/20 0.36
MAPK14 Q16539 1/20 0.36
ERBB2 P04626 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
SCHEMBL1884319 0.88 PIK3CD (0.47) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1879468 0.87 PIK3CD (0.42) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1886286 0.86 PIK3CD (0.54) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1879925 0.81 ATM (0.51) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1885110 0.80 GPBAR1 (0.42) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1598219 0.79 ATM (0.52) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1883295 0.79 PIK3CD (0.38) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1885747 0.77 ATM (0.40) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1881727 0.75 GAA (0.44) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1885847 0.75 ATM (0.51) PIK3CDATMDRD4DRD3L3MBTL1

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 4 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
EP-2231641-A2 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB Pharma, S.A. (BE) 2010-09-29 EP disclosed
WO-2009081105-A2 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-07-02 WO 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 545/4885DRD4 3720/4885

“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.