SCHEMBL1335484

SCHEMBL1335484

Cc1cc(N)ccc1-c1cccc2c1CNC2=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.59
ROCK1 Q13464 5/20 0.59
ROCK2 O75116 5/20 0.59
AURKB Q96GD4 5/20 0.59
CLK4 Q9HAZ1 4/20 0.59
RPS6KB1 P23443 4/20 0.59
TAOK1 Q7L7X3 4/20 0.59
HIPK4 Q8NE63 4/20 0.59
EPHA2 P29317 4/20 0.59
FLT4 P35916 4/20 0.59
FLT3 P36888 4/20 0.59
RET P07949 4/20 0.59
PLK4 O00444 3/20 0.59
NTRK1 P04629 3/20 0.59
MET P08581 3/20 0.59
NTRK2 Q16620 3/20 0.59
ALK Q9UM73 3/20 0.59
MAP4K4 O95819 3/20 0.59
LCK P06239 3/20 0.59
BLK P51451 3/20 0.59

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
SCHEMBL1334421 0.82 KDR (0.54) KDRROCK1ROCK2AURKBCLK4
SCHEMBL1334382 0.82 KDR (0.54) KDRROCK1ROCK2AURKBCLK4
SCHEMBL30775244 0.81 PARP10 (0.57) KDRROCK1ROCK2AURKBCLK4
SCHEMBL30543342 0.77 KDR (0.51) KDRROCK1ROCK2AURKBCLK4
SCHEMBL1333209 0.76 KDR (0.57) KDRROCK1ROCK2AURKBCLK4
SCHEMBL9475196 0.76 PARP1 (0.68) KDRROCK1ROCK2AURKBCLK4
SCHEMBL30331787 0.76 PARP1 (0.68) KDRROCK1ROCK2AURKBCLK4
SCHEMBL1334358 0.75 KDR (1.00) KDRROCK1ROCK2AURKBCLK4
SCHEMBL30775196 0.75 CLK4 (0.49) KDRROCK1ROCK2AURKBCLK4
SCHEMBL12469164 0.74 CSF1R (0.40) KDRROCK1ROCK2AURKBCLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110275630-A1 ISOINDOLINONE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2011-11-10 US disclosed
US-20100076051-A1 ISOINDOLINONE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2010-03-25 US disclosed
US-20060287370-A1 Isoindolinone kinase inhibitors CURTIN MICHAEL L 2006-12-21 US disclosed
US-7129260-B2 Isoindolinone kinase inhibitors ABBOTT LABORATORIES (US) 2006-10-31 US disclosed
EP-1633710-A1 ISOINDOLIN-1-ONE COMPOUNDS AS KINASE INHIBITORS Abbott Laboratories (US) 2006-03-15 EP disclosed
US-20050026976-A1 Isoindolinone kinase inhibitors ABBOTT LABORATORIES 2005-02-03 US disclosed
WO-2004108672-A1 ISOINDOLIN-1-ONE COMPOUNDS AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-12-16 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 (4 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-20060287370-A1 Isoindolinone kinase inhibitors ABL1, LCK, MAP3K7 KDR 527/4885ROCK1 315/4885ROCK2 264/4885
US-20050026976-A1 Isoindolinone kinase inhibitors ABL1, LCK, MAP3K7 KDR 527/4885ROCK1 315/4885ROCK2 264/4885
US-20100076051-A1 ISOINDOLINONE KINASE INHIBITORS ABL1, LCK, MAP3K7 KDR 527/4885ROCK1 315/4885ROCK2 264/4885
US-20110275630-A1 ISOINDOLINONE KINASE INHIBITORS MAP3K7, MAP3K5, MAP3K20 KDR 909/4885ROCK1 374/4885ROCK2 316/4885

“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.