SCHEMBL22280898

SCHEMBL22280898

Cc1cc(C)c(-c2ccc3c4ccc(O)cc4c4nccn4c3n2)c(C)c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
IKBKB O14920 1/20 0.30
RAPGEF4 Q8WZA2 1/20 0.30

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
SCHEMBL22280896 0.84 ALDH1A1 (0.34)
SCHEMBL22280911 0.79 CCNE1 (0.33) GRIA1CCNE1CDK2IKBKB
SCHEMBL22262082 0.79 CDK2 (0.33) GRIA1CCNE1CDK2IKBKB
SCHEMBL22280897 0.78 DRD1 (0.33) IKBKB
SCHEMBL21918379 0.75 PDE4D (0.40) CCNE1CDK2
SCHEMBL22280712 0.74 PDE2A (0.43)
SCHEMBL20561490 0.73 IKBKB (0.35) GRIA1CCNE1CDK2IKBKB
SCHEMBL12076941 0.67 MAPT (0.41) CCNE1CDK2
SCHEMBL29808108 0.67 MAPT (0.41) CCNE1CDK2
SCHEMBL22349169 0.66 CCNE1 (0.37) CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200239505-A1 BLUE PHOSPHORESCENT EMITTERS EMPLOYING FUNCTIONALIZED IMIDAZOPHENTHRIDINE AND ANALOGUES ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2020-07-30 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-20200239505-A1 BLUE PHOSPHORESCENT EMITTERS EMPLOYING FUNCTIONALIZED IMIDAZOPHENTHRIDINE AND ANALOGUES EML4, TYR, TYMP GRIA1 4481/4885CCNE1 3005/4885CDK2 435/4885

“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.