SCHEMBL2528281

SCHEMBL2528281

CC(C)(C)Oc1cc(-c2c[nH]c3ncccc23)cc(-c2ccc(Cl)cc2F)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 11/20 0.46
CDC7 O00311 15/20 0.45
ROCK2 O75116 14/20 0.45
PIM1 P11309 14/20 0.45
PRKACA P17612 14/20 0.45
CDK2 P24941 13/20 0.45
HIPK2 Q9H2X6 13/20 0.45
GSK3B P49841 13/20 0.45
CLK4 Q9HAZ1 11/20 0.45
MAP4K4 O95819 11/20 0.45
CDK7 P50613 9/20 0.45
CDK9 P50750 9/20 0.45
STK17A Q9UEE5 7/20 0.45
DAPK3 O43293 7/20 0.45
PRKD3 O94806 7/20 0.45
PAK4 O96013 7/20 0.45
CLK2 P49760 7/20 0.45
PRKX P51817 7/20 0.45
CDK5 Q00535 7/20 0.45
MAP4K2 Q12851 7/20 0.45

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
SCHEMBL2534550 0.82 BRD4 (0.50) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2534178 0.82 CDC7 (0.63) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2534175 0.81 DYRK1A (0.51) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2533349 0.80 BRD4 (0.53) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2525011 0.80 BRD4 (0.47) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL28805250 0.80 DYRK1A (0.49) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2528668 0.80 DYRK1A (0.49) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2528276 0.79 DYRK1A (0.49) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2534555 0.78 DYRK1A (0.53) DYRK1ACDC7ROCK2PIM1PRKACA
SCHEMBL2529657 0.78 BRD4 (0.48) DYRK1ACDC7ROCK2PIM1PRKACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181246-B2 Pyrrolopyridine inhibitors of kinases ABBVIE INC. (US) 2015-11-10 US disclosed
US-20140357616-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBVIE INC (US) 2014-12-04 US disclosed
US-8822446-B2 Pyrrolopyridine inhibitors of kinases ABBVIE INC. (US) 2014-09-02 US disclosed
EP-2560971-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-02-27 EP disclosed
WO-2011133388-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-10-27 WO disclosed
US-20110257152-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-10-20 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 (2 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-20140357616-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES CDC7, MAP3K7, CDK1 DYRK1A 355/4885CDC7 1/4885ROCK2 373/4885
US-20110257152-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES CDC7, MAP3K7, CDK1 DYRK1A 355/4885CDC7 1/4885ROCK2 373/4885

“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.