SCHEMBL3450285

SCHEMBL3450285

CC(=O)c1cccc(Nc2ncc(Br)c(-n3ccc(C(F)(F)F)n3)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.52
CDK19 Q9BWU1 1/20 0.43
ALK Q9UM73 1/20 0.43
BTK Q06187 5/20 0.43
AURKA O14965 3/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
PLK1 P53350 1/20 0.43
CCNA1 P78396 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
EGFR P00533 5/20 0.42
PTK2 Q05397 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LCK P06239 1/20 0.41
ITK Q08881 1/20 0.40

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
SCHEMBL3450568 0.91 SYK (0.52) SYKCDK19ALKBTKAURKA
SCHEMBL3448902 0.85 AURKA (0.46) SYKAURKACCNA2CDK2PTK2
SCHEMBL3450220 0.85 SYK (0.52) SYKCDK19ALKBTKAURKA
SCHEMBL3448088 0.84 TBK1 (0.44) SYK
SCHEMBL3373625 0.83 MAPT (0.48) SYKHDAC3HDAC1HDAC2HDAC6
SCHEMBL3449881 0.82 SYK (0.49) SYKAURKA
SCHEMBL3450149 0.81 SYK (0.50) SYKBTKCDK2EGFRPTK2
SCHEMBL3450687 0.81 JAK3 (0.54) SYKAURKAPTK2LCK
SCHEMBL3373080 0.80 NPC1 (0.46) SYKMAPT
SCHEMBL3449826 0.80 SYK (0.45) SYKBTKEGFRLCK

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 804/4885CDK19 3332/4885ALK 3205/4885

“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.