SCHEMBL1468059

SCHEMBL1468059

NC1CCCN(c2c(C(F)(F)F)cnc3[nH]cc(NC(=O)c4cccnc4)c23)C1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 10/20 0.46
PRKCA P17252 1/20 0.46
GSK3B P49841 1/20 0.46
PRKCQ Q04759 1/20 0.46
AAK1 Q2M2I8 3/20 0.46
PIM3 Q86V86 5/20 0.45
PIM1 P11309 4/20 0.45
ROCK2 O75116 3/20 0.42
ROCK1 Q13464 3/20 0.42
CDC42BPB Q9Y5S2 3/20 0.42
CDC42BPA Q5VT25 1/20 0.42
HDAC1 Q13547 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL1468054 1.00 PIM2 (0.46) PIM2PRKCAGSK3BPRKCQAAK1
Hydrochloric Acid SCHEMBL1468771 0.99 PIM2 (0.46) PIM2PRKCAGSK3BPRKCQAAK1
Hydrochloric Acid SCHEMBL1468769 0.99 PIM2 (0.46) PIM2PRKCAGSK3BPRKCQAAK1
SCHEMBL1468662 0.89 PIM2 (0.47) PIM2AAK1PIM3PIM1ROCK2
SCHEMBL1468665 0.89 PIM2 (0.47) PIM2AAK1PIM3PIM1ROCK2
Hydrochloric Acid SCHEMBL1467780 0.89 PIM2 (0.46) PIM2AAK1PIM3PIM1ROCK2
Hydrochloric Acid SCHEMBL1467783 0.89 PIM2 (0.46) PIM2AAK1PIM3PIM1ROCK2
SCHEMBL16994893 0.88 AAK1 (0.43) PIM2PRKCAGSK3BPRKCQAAK1
SCHEMBL16368938 0.88 PIM2 (0.42) PIM2PRKCAGSK3BPRKCQAAK1
SCHEMBL1468800 0.88 PIM2 (0.47) PIM2AAK1PIM3PIM1ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9969727-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA INC. (US) 2018-05-15 US disclosed
US-20160368916-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-12-22 US disclosed
US-9365568-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA INC. (US) 2016-06-14 US disclosed
EP-2990407-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-03-02 EP disclosed
US-20150322061-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2015-11-12 US disclosed
EP-2307409-B1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-08-12 EP disclosed
US-8758830-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-06-24 US disclosed
US-20140100369-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2014-04-10 US disclosed
US-8545897-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA INC. (US) 2013-10-01 US disclosed
US-20130045286-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2013-02-21 US disclosed
US-8178131-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA INC. (US) 2012-05-15 US disclosed
US-20110070317-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-03-24 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 (5 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-20160368916-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A PIM2 697/4885PRKCA 40/4885GSK3B 910/4885
US-20140100369-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A PIM2 697/4885PRKCA 40/4885GSK3B 910/4885
US-20110070317-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, BUB1B PIM2 622/4885PRKCA 30/4885GSK3B 735/4885
US-20150322061-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A PIM2 697/4885PRKCA 40/4885GSK3B 910/4885
US-20130045286-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A PIM2 697/4885PRKCA 40/4885GSK3B 910/4885

“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.