SCHEMBL1855671

SCHEMBL1855671

CCOC(=O)c1cccc(-c2ccnc3cc(Cc4cccc(C(F)(F)F)c4)nn23)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.51
SYK P43405 1/20 0.45
FYN P06241 2/20 0.44
DYRK3 O43781 1/20 0.43
CCNT1 O60563 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CDK9 P50750 1/20 0.43
CDK5 Q00535 1/20 0.43
DYRK1A Q13627 1/20 0.43
CDK5R1 Q15078 1/20 0.43
DYRK2 Q92630 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
PDE4D Q08499 1/20 0.41

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
SCHEMBL1851648 0.88 BRAF (0.50) BRAFFYNPDE4D
SCHEMBL3209898 0.82 GPR52 (0.55) BRAF
SCHEMBL1852034 0.81 MAPT (0.43) BRAFSYKDYRK3CCNT1CCNA2
SCHEMBL3215890 0.80 GPR52 (0.49) BRAF
SCHEMBL1854941 0.77 BRAF (0.46) BRAFSYKDYRK3CCNT1CCNA2
SCHEMBL4655652 0.76 BRAF (0.72) BRAF
SCHEMBL1848852 0.74 GPR52 (0.51) BRAFSYK
SCHEMBL1862448 0.74 GPR52 (0.51) BRAFSYK
SCHEMBL1851359 0.74 GPR52 (0.51) BRAFSYK
SCHEMBL1855742 0.73 KCNN3 (0.42) CCNA2CDK2CDK5DYRK1ACDK5R1

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
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 BRAF 4083/4885SYK 1791/4885FYN 1500/4885

“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.