SCHEMBL1469330

SCHEMBL1469330

NC1CCCN(c2c(-c3ccccc3)cnc3[nH]cc(NC(=O)c4cccnc4)c23)C1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 5/20 0.49
MAP4K1 Q92918 1/20 0.47
ROCK2 O75116 4/20 0.46
ROCK1 Q13464 4/20 0.46
CDC42BPB Q9Y5S2 4/20 0.46
CDC42BPA Q5VT25 1/20 0.46
PIM3 Q86V86 6/20 0.45
PIM2 Q9P1W9 6/20 0.45
PIM1 P11309 4/20 0.45
LRRK2 Q5S007 2/20 0.44
HDAC1 Q13547 1/20 0.42

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
SCHEMBL1469328 1.00 AAK1 (0.49) AAK1MAP4K1ROCK2ROCK1CDC42BPB
Hydrochloric Acid SCHEMBL1468227 0.99 AAK1 (0.49) AAK1MAP4K1ROCK2ROCK1CDC42BPB
Hydrochloric Acid SCHEMBL1468229 0.99 AAK1 (0.49) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL10222699 0.93 AAK1 (0.51) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL14695584 0.91 AAK1 (0.47) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL1468772 0.91 AAK1 (0.47) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL1468665 0.89 PIM2 (0.47) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL1468662 0.89 PIM2 (0.47) AAK1MAP4K1ROCK2ROCK1CDC42BPB
SCHEMBL1468272 0.89 AAK1 (0.48) AAK1ROCK2ROCK1CDC42BPBPIM1
Hydrochloric Acid SCHEMBL1467780 0.89 PIM2 (0.46) AAK1MAP4K1ROCK2ROCK1CDC42BPB

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 AAK1 438/4885MAP4K1 82/4885ROCK2 1602/4885
US-20140100369-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A AAK1 438/4885MAP4K1 82/4885ROCK2 1602/4885
US-20110070317-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, BUB1B AAK1 453/4885MAP4K1 75/4885ROCK2 1355/4885
US-20150322061-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A AAK1 438/4885MAP4K1 82/4885ROCK2 1602/4885
US-20130045286-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, CDKN1A AAK1 438/4885MAP4K1 82/4885ROCK2 1602/4885

“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.