SCHEMBL3451464

SCHEMBL3451464

COC(=O)c1cc(-c2cnc(Nc3cccc(C(C)=O)c3)nc2-n2ccc(C(F)(F)F)n2)cnc1OC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.45
BTK Q06187 4/20 0.41
EGFR P00533 3/20 0.41
LCK P06239 3/20 0.40
CTSC P53634 1/20 0.39
BRAF P15056 2/20 0.38
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
SRC P12931 1/20 0.38
RAF1 P04049 1/20 0.37
ITK Q08881 1/20 0.37
PTK2 Q05397 1/20 0.37
AURKA O14965 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
PLK1 P53350 1/20 0.36
CCNA1 P78396 1/20 0.36

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
SCHEMBL3449826 0.94 SYK (0.45) SYKBTKEGFRLCKCTSC
SCHEMBL3449546 0.93 SYK (0.44) SYKBTKEGFRLCKABL1
SCHEMBL3449088 0.91 SYK (0.40) SYKBTKLCKAURKA
SCHEMBL3446985 0.90 MAPT (0.45) SYK
SCHEMBL13311961 0.88 ABL1 (0.36) SYKBTKEGFRLCKABL1
SCHEMBL3449553 0.88 CNR2 (0.42) SYKBTKEGFRPTK2
SCHEMBL3448155 0.88 SYK (0.45) SYKBTKEGFRLCKCTSC
SCHEMBL3449155 0.87 SYK (0.44) SYKBTKEGFRLCKAURKA
SCHEMBL3376690 0.87 TYRO3 (0.40) SYKBTKEGFRLCKPTK2
SCHEMBL3373679 0.87 NPC1 (0.44) SYK

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 SYK 804/4885BTK 1019/4885EGFR 2771/4885

“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.