SCHEMBL2063533

SCHEMBL2063533

COc1cc2c(Cl)c(C3CC3)cnc2cc1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK1 P51617 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.53
EGFR P00533 4/20 0.48
SRC P12931 1/20 0.48
KDR P35968 1/20 0.48
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
KIT P10721 3/20 0.47
PDPK1 O15530 1/20 0.46
KDM1A O60341 1/20 0.46
TLR9 Q9NR96 2/20 0.46
TLR7 Q9NYK1 2/20 0.46
NSD2 O96028 1/20 0.45
TRPC6 Q9Y210 1/20 0.45
ACHE P22303 1/20 0.44
BACE1 P56817 1/20 0.44
ELANE P08246 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL19645707 0.82 PDGFRB (0.53) IRAK1IRAK4EGFRSRCKDR
SCHEMBL31554474 0.81 PDGFRB (0.52) IRAK1IRAK4EGFRSRCKDR
SCHEMBL31554584 0.81 PDPK1 (0.54) IRAK1IRAK4EGFRSRCKDR
SCHEMBL2063193 0.81 PDGFRB (0.52) IRAK1IRAK4EGFRSRCKDR
SCHEMBL12335689 0.80 PDGFRB (0.50) IRAK1IRAK4EGFRSRCKDR
SCHEMBL15263519 0.79 SRC (0.61) EGFRSRCKDRPDGFRBPDGFRA
SCHEMBL1893875 0.79 SRC (0.61) EGFRSRCKDRPDGFRBPDGFRA
SCHEMBL5929650 0.79 EGFR (0.53) EGFRPDGFRBPDGFRAPDPK1KDM1A
SCHEMBL5452461 0.79 EGFR (0.49) IRAK1IRAK4EGFRSRCKDR
SCHEMBL168494 0.77 PIN1 (0.49) PDGFRBPDGFRAPDPK1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148531-B2 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2012-04-03 US disclosed
US-8148531-B2 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2012-04-03 US disclosed
US-8148531-B2 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2012-04-03 US disclosed
EP-1877383-B1 QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2011-09-07 EP disclosed
EP-1877383-B1 QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2011-09-07 EP disclosed
US-20090131461-A1 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2009-05-21 US disclosed
US-20090131461-A1 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2009-05-21 US disclosed
US-20090131461-A1 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2009-05-21 US disclosed
EP-1877383-A1 QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY Chroma Therapeutics Limited (GB) 2008-01-16 EP disclosed
WO-2006117552-A1 QUINOLINE AND QUINOXALINE DERIVATIVES AS INHIBITORS OF KINASE ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2006-11-09 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-20090131461-A1 Quinoline and quinoxaline derivatives as inhibitors of kinase enzymatic activity CDK1, AURKC, CSNK1G3 IRAK1 1891/4885IRAK4 2798/4885EGFR 1296/4885

“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.