SCHEMBL3448011

SCHEMBL3448011

CONC(=O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2nc(C(F)F)cc2C(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
THRB P10828 1/20 0.37
EGFR P00533 6/20 0.36
CSNK2A1 P68400 4/20 0.35
SYK P43405 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
STK17A Q9UEE5 2/20 0.34
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
MAPK1 P28482 1/20 0.34
STK17B O94768 1/20 0.34
CSNK1A1 P48729 1/20 0.34
TDO2 P48775 1/20 0.33

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
SCHEMBL3449258 0.93 ABL1 (0.39) ABL1BCRTHRBEGFRCSNK2A1
SCHEMBL3463873 0.90 EGFR (0.39) ABL1BCRTHRBEGFRCSNK2A1
SCHEMBL3449032 0.90 XDH (0.40) THRBEGFRCSNK2A1L3MBTL1STK17A
SCHEMBL3447262 0.88 RXFP1 (0.40) ABL1BCRTHRBEGFRCSNK2A1
SCHEMBL3450187 0.85 CSNK2A1 (0.40) ABL1BCRTHRBEGFRCSNK2A1
SCHEMBL3447526 0.84 ABL1 (0.43) ABL1BCREGFRCSNK2A1SYK
SCHEMBL3448814 0.84 EGFR (0.39) ABL1BCRTHRBEGFRSYK
SCHEMBL3450030 0.84 ABL1 (0.38) ABL1BCREGFRCSNK2A1SYK
SCHEMBL3451486 0.83 THRB (0.43) ABL1BCRTHRBEGFRCSNK2A1
SCHEMBL3450614 0.82 ABL1 (0.41) ABL1BCREGFRCSNK2A1SYK

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 ABL1 370/4885BCR 3224/4885THRB 3527/4885

“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.