SCHEMBL10269232

SCHEMBL10269232

COc1cccc(C(=O)Nc2n[nH]c3ccc(Nc4ccnc(N)n4)cc23)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 6/20 0.57
MAPKAPK2 P49137 5/20 0.52
CDK7 P50613 2/20 0.49
CDC7 O00311 1/20 0.49
DAPK3 O43293 1/20 0.49
JAK2 O60674 1/20 0.49
ROCK2 O75116 1/20 0.49
MAP4K4 O95819 1/20 0.49
PAK4 O96013 1/20 0.49
PRKACA P17612 1/20 0.49
CDK2 P24941 1/20 0.49
FLT3 P36888 1/20 0.49
CSNK1A1 P48729 1/20 0.49
CLK2 P49760 1/20 0.49
GSK3A P49840 1/20 0.49
CDK9 P50750 1/20 0.49
PRKX P51817 1/20 0.49
CDK5 Q00535 1/20 0.49
MAP4K2 Q12851 1/20 0.49
CAMK2D Q13557 1/20 0.49

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
SCHEMBL14404257 0.88 ROCK1 (0.53) ROCK1MAPKAPK2JAK2ROCK2ULK1
SCHEMBL10269739 0.87 MAPKAPK2 (0.58) ROCK1MAPKAPK2CDK7JAK2ITK
SCHEMBL10269234 0.86 MAPKAPK2 (0.49) ROCK1MAPKAPK2JAK2ROCK2NPC1
SCHEMBL10268598 0.81 MAPKAPK2 (0.71) ROCK1MAPKAPK2ROCK2PRKACADYRK1A
SCHEMBL758654 0.80 CDK7 (0.58) ROCK1CDK7CDC7DAPK3JAK2
SCHEMBL10214706 0.76 MAPKAPK2 (0.64) ROCK1MAPKAPK2JAK2ROCK2ITK
SCHEMBL2527438 0.76 FLT3 (0.62) CDK7CDC7DAPK3JAK2ROCK2
SCHEMBL10269411 0.75 ROCK1 (0.55) ROCK1MAPKAPK2JAK2CDK2FLT3
SCHEMBL10269154 0.75 MAPKAPK2 (0.77) ROCK1MAPKAPK2KDRITK
SCHEMBL10269200 0.75 ROCK1 (0.56) ROCK1MAPKAPK2ROCK2CDK2FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 ROCK1 2438/4885MAPKAPK2 1905/4885CDK7 693/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 ROCK1 2438/4885MAPKAPK2 1905/4885CDK7 693/4885

“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.