SCHEMBL13312489

SCHEMBL13312489

Fc1ccc(Nc2ncc(-c3cnc4[nH]ccc4c3)c(-n3ccc(C(F)(F)F)n3)n2)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 6/20 0.39
STK17A Q9UEE5 3/20 0.38
STK17B O94768 2/20 0.38
TNIK Q9UKE5 2/20 0.38
MAPK1 P28482 1/20 0.37
PIK3CA P42336 1/20 0.36
NUDT1 P36639 1/20 0.36
SYK P43405 1/20 0.35
FEN1 P39748 1/20 0.35
CDK8 P49336 2/20 0.34
CTSC P53634 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
SCHEMBL3449322 0.87 MAPK1 (0.47) ULK1STK17ASTK17BMAPK1SYK
SCHEMBL3450906 0.86 ULK1 (0.36) ULK1STK17ATNIKNUDT1FEN1
SCHEMBL3449320 0.85 MAPK1 (0.42) ULK1STK17ASTK17BMAPK1CTSC
SCHEMBL3450762 0.82 STK17A (0.41) ULK1STK17ASTK17BMAPK1SYK
SCHEMBL3450566 0.82 ULK1 (0.38) ULK1STK17ASTK17BMAPK1SYK
SCHEMBL3375503 0.82 SYK (0.40) ULK1MAPK1SYK
SCHEMBL3372082 0.82 XDH (0.40) ULK1SYK
SCHEMBL3374672 0.81 SYK (0.48) SYK
SCHEMBL3450069 0.81 SYK (0.42) ULK1STK17ASTK17BMAPK1SYK
SCHEMBL3452335 0.81 IDH1 (0.47) ULK1STK17ASTK17BMAPK1SYK

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 3 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
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 ULK1 2054/4885STK17A 1984/4885STK17B 2457/4885

“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.