SCHEMBL13625357

SCHEMBL13625357

CC(=O)c1cc2cc(C)cnc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 17/20 0.42
SRC P12931 13/20 0.42
HRH4 Q9H3N8 1/20 0.39
CCR1 P32246 1/20 0.37
CCR5 P51681 1/20 0.37
CCR8 P51685 1/20 0.37

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
SCHEMBL13625358 0.86 PIN1 (0.51) ABL1SRCHRH4
SCHEMBL17324213 0.83 ABL1 (0.56) ABL1SRC
SCHEMBL13625359 0.83 ABL1 (0.40) ABL1SRCHRH4
SCHEMBL1772735 0.81 ABL1 (0.40) ABL1SRCHRH4
SCHEMBL15859989 0.80 MGAM (0.42) ABL1SRCHRH4
SCHEMBL5218804 0.80 KDM4E (0.57) ABL1SRC
SCHEMBL15860112 0.79 ABL1 (0.41) ABL1SRCHRH4
SCHEMBL15223892 0.79 ABL1 (0.45) ABL1SRC
SCHEMBL15847133 0.78 ABL1 (0.38) ABL1SRCHRH4
SCHEMBL1773116 0.76 CYP1A2 (0.42) ABL1SRCHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622466-B2 Azaindole-2-carboxamide derivatives HOFFMAN-LA ROCHE INC. (US) 2009-11-24 US disclosed
US-20090005379-A1 Azaindole-2-Carboxamide Derivatives HOFFMANN-LA ROCHE, INC. 2009-01-01 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 (1 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-20090005379-A1 Azaindole-2-Carboxamide Derivatives HRH3, HRH4, H1-5 ABL1 524/4885SRC 2937/4885HRH4 2/4885

“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.