SCHEMBL1885847

SCHEMBL1885847

CCc1ccccc1-c1nc2c(C)cccc2cc1CBr

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
PIK3CD O00329 16/20 0.46
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL1598219 0.89 ATM (0.52) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1888310 0.86 PIK3CD (0.54) ATMPIK3CD
SCHEMBL10285528 0.84 ATM (0.57) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL12728068 0.84 ATM (0.51) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1598041 0.84 PIK3CD (0.64) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1879925 0.84 ATM (0.51) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1881032 0.83 ATM (0.50) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1884319 0.80 PIK3CD (0.47) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1882580 0.80 ATM (0.50) ATMPIK3CDDRD4DRD3L3MBTL1
SCHEMBL1883713 0.80 PIK3CD (0.48) ATMPIK3CD

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 ATM 545/4885PIK3CD 8/4885DRD4 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.