SCHEMBL3724342

SCHEMBL3724342

COc1ccc(-c2cnc3[nH]ccc3c2N2CCN(C(=O)C(CN(C(=O)OC(C)(C)C)C(C)C)c3ccc(Cl)cc3)CC2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 4/20 0.43
AKT1 P31749 11/20 0.42
KIT P10721 2/20 0.37
AKT3 Q9Y243 4/20 0.36
AKT2 P31751 3/20 0.36
JAK1 P23458 2/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
ROCK2 O75116 1/20 0.35
IL2 P60568 2/20 0.34
TACR3 P29371 1/20 0.34

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
SCHEMBL3724343 1.00 MAP4K1 (0.43) MAP4K1AKT1KITAKT3AKT2
SCHEMBL3723656 0.91 MAP4K1 (0.45) MAP4K1AKT1KITAKT3AKT2
SCHEMBL3722089 0.90 AKT1 (0.41) AKT1KITAKT3AKT2JAK1
SCHEMBL3722091 0.90 AKT1 (0.41) AKT1KITAKT3AKT2JAK1
SCHEMBL3720662 0.90 AKT1 (0.44) AKT1KITAKT3AKT2JAK1
SCHEMBL3720660 0.90 AKT1 (0.44) AKT1KITAKT3AKT2JAK1
SCHEMBL3730492 0.89 AKT1 (0.45) AKT1AKT3AKT2JAK1
SCHEMBL3730489 0.89 AKT1 (0.45) AKT1AKT3AKT2JAK1
SCHEMBL3725411 0.89 AKT1 (0.42) AKT1KITAKT3AKT2JAK1
SCHEMBL3725412 0.89 AKT1 (0.42) AKT1KITAKT3AKT2JAK1

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-8841304-B2 Pyrrolopyridines as kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-09-23 US disclosed
US-20140221370-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2014-08-07 US disclosed
EP-2242755-B1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2012-09-12 EP disclosed
US-20100324041-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-12-23 US disclosed
EP-2242755-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS Array Biopharma, Inc. (US) 2010-10-27 EP disclosed
WO-2009089352-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-07-16 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 (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-20140221370-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, BUB1B MAP4K1 75/4885AKT1 537/4885KIT 1127/4885
US-20100324041-A1 PYRROLOPYRIDINES AS KINASE INHIBITORS CHEK2, CHEK1, BUB1B MAP4K1 65/4885AKT1 531/4885KIT 1158/4885

“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.