SCHEMBL3449507

SCHEMBL3449507

COCCN1CCN(c2nc(Nc3ccc(F)c(Cl)c3)ncc2Br)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.49
INSR P06213 4/20 0.46
ALK Q9UM73 4/20 0.46
MET P08581 3/20 0.45
EGFR P00533 4/20 0.45
AURKA O14965 1/20 0.43
CDK4 P11802 1/20 0.43
MAPK1 P28482 1/20 0.42
SYK P43405 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
SCHEMBL3449451 0.86 AXL (0.57) AXLALKEGFRAURKAMAPK1
SCHEMBL3449764 0.83 MAPK1 (0.51) AXLEGFRMAPK1
SCHEMBL3452720 0.83 MAPK1 (0.51) AXLEGFRMAPK1
SCHEMBL3450023 0.82 MAPK1 (0.50) AXLEGFRMAPK1
SCHEMBL3449638 0.82 MAPK1 (0.50) AXLEGFRMAPK1
SCHEMBL3451168 0.82 MAPK1 (0.44) AXLEGFRMAPK1
SCHEMBL3450656 0.81 MAPK1 (0.49) AXLEGFRMAPK1
SCHEMBL3450848 0.80 MET (0.44) AXLINSRALKMETEGFR
SCHEMBL13310378 0.80 BRD4 (0.52) AXLEGFRCDK4MAPK1
SCHEMBL3344180 0.80 NPC1 (0.53) EGFRAURKAMAPK1SYK

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
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD AXL 2812/4885INSR 3066/4885ALK 3205/4885

“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.