SCHEMBL3448261

SCHEMBL3448261

CN(C)CCNc1nc(Nc2ccc(F)c(Cl)c2)ncc1Br

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 15/20 0.59
STK17B O94768 10/20 0.59
CSNK2A1 P68400 1/20 0.51
SOS1 Q07889 1/20 0.49
AXL P30530 1/20 0.46
MAPK1 P28482 1/20 0.45
CCNT1 O60563 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
CDK9 P50750 1/20 0.44

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
SCHEMBL3447158 0.94 STK17A (0.62) STK17ASTK17B
SCHEMBL3448855 0.88 STK17A (0.62) STK17ASTK17BAXLMAPK1
SCHEMBL3450582 0.85 STK17A (0.59) STK17ASTK17BCSNK2A1AXL
SCHEMBL13310320 0.84 STK17A (0.56) STK17ASTK17B
SCHEMBL3375644 0.84 STK17A (0.56) STK17ASTK17BAXLMAPK1
SCHEMBL3448215 0.83 STK17A (0.62) STK17ASTK17B
SCHEMBL3449490 0.83 STK17A (0.57) STK17ASTK17BAXL
Hydrochloric Acid SCHEMBL3449916 0.83 STK17A (0.55) STK17ASTK17B
SCHEMBL13310818 0.83 STK17A (0.54) STK17ASTK17BCSNK2A1SOS1AXL
SCHEMBL3449022 0.82 STK17A (0.59) STK17ASTK17B

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 4 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

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.