SCHEMBL3345683

SCHEMBL3345683

CCOC(=O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2NCCCN(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 8/20 0.50
STK17B O94768 5/20 0.48
CSNK2A1 P68400 1/20 0.44
JAK1 P23458 3/20 0.42
BLK P51451 3/20 0.42
JAK3 P52333 3/20 0.42
JAK2 O60674 2/20 0.42
FLT1 P17948 2/20 0.42
FLT4 P35916 2/20 0.42
TBK1 Q9UHD2 2/20 0.42
SIRT5 Q9NXA8 4/20 0.42
BCL6 P41182 2/20 0.40
ITK Q08881 1/20 0.40
EGFR P00533 1/20 0.40
CCNT1 O60563 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
CDK9 P50750 1/20 0.40

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
SCHEMBL3449601 0.95 CSNK2A1 (0.48) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3449568 0.92 STK17A (0.51) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3448587 0.91 STK17A (0.50) STK17ASTK17BCSNK2A1SIRT5EGFR
SCHEMBL3447211 0.90 STK17A (0.51) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3377446 0.90 CSNK2A1 (0.52) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3451827 0.88 CSNK2A1 (0.49) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3376119 0.88 STK17A (0.52) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3452481 0.88 STK17A (0.49) STK17ASTK17BCSNK2A1SIRT5EGFR
SCHEMBL3450274 0.88 STK17A (0.49) STK17ASTK17BCSNK2A1JAK1BLK
SCHEMBL3448597 0.87 STK17A (0.46) STK17ASTK17BCSNK2A1JAK1BLK

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 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 (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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD STK17A 1984/4885STK17B 2457/4885CSNK2A1 1858/4885

“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.