SCHEMBL645873

SCHEMBL645873

Fc1ccc(-c2ccc3ocnc3c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.60
CLK1 P49759 1/20 0.49
CLK2 P49760 1/20 0.49
CLK3 P49761 1/20 0.49
GSK3B P49841 1/20 0.49
CDK9 P50750 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
CTNNB1 P35222 3/20 0.44
WNT3A P56704 3/20 0.44
FASN P49327 1/20 0.44
MAP4K4 O95819 1/20 0.44
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
PGR P06401 1/20 0.41
PIK3CD O00329 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
SCHEMBL28048555 0.88 DYRK1A (0.72) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL28172473 0.85 DYRK1A (0.60) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL29372420 0.84 CTNNB1 (0.53) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL1585861 0.84 CTNNB1 (0.53) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL17068937 0.84 CTNNB1 (0.53) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL29375136 0.83 DYRK1A (0.62) DYRK1ACTNNB1WNT3AFASNMAP4K4
SCHEMBL592989 0.83 DYRK1A (0.62) DYRK1ACTNNB1WNT3AFASNMAP4K4
SCHEMBL8080835 0.81 DYRK1A (0.60) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL8076216 0.81 DYRK1A (0.60) DYRK1ACLK1CLK2CLK3GSK3B
SCHEMBL10337032 0.81 DYRK1A (0.60) DYRK1ACLK1CLK2CLK3GSK3B

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2172534-B1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES (JP) 2014-11-19 EP disclosed
CN-101679857-B Light-emitting device material and light-emitting device TORAY INDUSTRIES 2012-11-28 CN disclosed
US-8120022-B2 Light emitting device material and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-21 US disclosed
US-20100187520-A1 LIGHT EMITTING DEVICE MATERIAL AND LIGHT EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2010-07-29 US disclosed
EP-2172534-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE Toray Industries, Inc. (JP) 2010-04-07 EP disclosed
CN-101679857-A Light-emitting device material and light-emitting device TORAY INDUSTRIES 2010-03-24 CN 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-20100187520-A1 LIGHT EMITTING DEVICE MATERIAL AND LIGHT EMITTING DEVICE LEF1, CRY1, SOD1 DYRK1A 3219/4885CLK1 1406/4885CLK2 1304/4885

“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.