SCHEMBL3344858

SCHEMBL3344858

Fc1ccc(Nc2ncc(Br)c(Cl)n2)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.57
STK17A Q9UEE5 4/20 0.54
STK17B O94768 3/20 0.54
APP P05067 2/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
ULK1 O75385 1/20 0.47
SYK P43405 1/20 0.47
AXL P30530 1/20 0.45
EGFR P00533 3/20 0.44
KDR P35968 2/20 0.44
CSNK1A1 P48729 1/20 0.43
SOS1 Q07889 1/20 0.43
IGF1R P08069 1/20 0.43
RAPGEF4 Q8WZA2 1/20 0.42

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
SCHEMBL13310349 0.86 MAPK1 (0.54) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3344593 0.85 STK17A (0.60) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3344899 0.83 APP (0.54) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3350947 0.83 MAPK1 (0.51) MAPK1STK17ASTK17BAPPCA12
SCHEMBL22404983 0.82 MAPK1 (0.55) MAPK1STK17ASTK17BAPPCA12
SCHEMBL30091763 0.82 MAPK1 (0.55) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3447144 0.81 MAPK1 (0.47) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3447961 0.81 MAPK1 (0.49) MAPK1STK17ASTK17BAPPCA12
SCHEMBL3350815 0.81 STK17A (0.45) STK17ASTK17BCA1SYK
SCHEMBL3458921 0.81 CDK1 (0.57) MAPK1STK17ASTK17BAPPCA2

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 MAPK1 2905/4885STK17A 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.