SCHEMBL3450032

SCHEMBL3450032

CC(=O)Nc1cc(C(=O)O)cc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2ccc(C(F)(F)F)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
SYK P43405 8/20 0.40
CSNK2A1 P68400 2/20 0.38
AURKA O14965 1/20 0.37
PTGER1 P34995 1/20 0.37
EGFR P00533 1/20 0.37
WEE1 P30291 1/20 0.37
FYN P06241 1/20 0.37

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
SCHEMBL3372082 0.88 XDH (0.40) SYKCSNK2A1AURKAEGFR
SCHEMBL3374672 0.87 SYK (0.48) SYKCSNK2A1AURKA
SCHEMBL3375503 0.83 SYK (0.40) SYKCSNK2A1
SCHEMBL3450069 0.82 SYK (0.42) SYKAURKAEGFR
SCHEMBL3374661 0.82 SYK (0.45) SYKCSNK2A1EGFR
SCHEMBL3450388 0.82 MAPT (0.43) SYK
SCHEMBL3448901 0.82 EGFR (0.41) SYKCSNK2A1AURKAEGFR
SCHEMBL3448235 0.82 SYK (0.49) SYKAURKA
SCHEMBL3449213 0.82 SYK (0.41) SYKEGFR
SCHEMBL3447850 0.82 CSNK2A1 (0.39) CSNK2A1EGFR

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 IDO1 1332/4885TDO2 1735/4885SYK 804/4885

“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.