SCHEMBL3375644

SCHEMBL3375644

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

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 11/20 0.56
STK17B O94768 6/20 0.56
MAPK1 P28482 1/20 0.47
AXL P30530 1/20 0.46
ULK1 O75385 1/20 0.45
ALDH1A1 P00352 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TNK2 Q07912 1/20 0.45
SYK P43405 1/20 0.44
IGF1R P08069 2/20 0.44
CDK1 P06493 1/20 0.44
INSR P06213 1/20 0.43
FGFR1 P11362 1/20 0.43
KDR P35968 1/20 0.43

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
SCHEMBL3448855 0.84 STK17A (0.62) STK17ASTK17BMAPK1AXL
SCHEMBL3448261 0.84 STK17A (0.59) STK17ASTK17BMAPK1AXL
SCHEMBL3344593 0.83 STK17A (0.60) STK17ASTK17BMAPK1AXLULK1
SCHEMBL3447158 0.82 STK17A (0.62) STK17ASTK17B
SCHEMBL3450081 0.81 STK17A (0.53) STK17ASTK17BMAPK1AXLULK1
SCHEMBL3450582 0.81 STK17A (0.59) STK17ASTK17BAXLSYK
Hydrochloric Acid SCHEMBL3451159 0.81 STK17A (0.53) STK17ASTK17BMAPK1AXLULK1
SCHEMBL13310336 0.80 CSNK2A1 (0.55) STK17ASTK17BIGF1RCDK1FGFR1
SCHEMBL3449490 0.80 STK17A (0.57) STK17ASTK17BAXL
SCHEMBL3449788 0.80 STK17A (0.57) STK17ASTK17BMAPK1AXLULK1

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 2 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
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 2457/4885MAPK1 2905/4885

“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.