SCHEMBL22280704

SCHEMBL22280704

CC(C)c1cccc(C(C)C)c1-c1ccc2c3ccc(O)cc3c3nccn3c2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 2/20 0.34
CDK2 P24941 2/20 0.34
CASR P41180 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
ANPEP P15144 1/20 0.32
DPP4 P27487 1/20 0.32
CCNE2 O96020 1/20 0.32
OPRK1 P41145 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NCOA3 Q9Y6Q9 1/20 0.30
HSD11B1 P28845 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
SCHEMBL22262082 0.81 CDK2 (0.33) CCNE1CDK2ESR1ESR2CCNE2
SCHEMBL22280686 0.80 ESR1 (0.40) CCNE1CDK2ESR1ESR2CCNE2
SCHEMBL22280711 0.76 ESR1 (0.41) CASRESR1ESR2KDM4EMEN1
SCHEMBL12076941 0.75 MAPT (0.41) CCNE1CDK2CCNE2KDM4EMEN1
SCHEMBL29808108 0.75 MAPT (0.41) CCNE1CDK2CCNE2KDM4EMEN1
SCHEMBL22262081 0.74 ESR1 (0.39) CCNE1CDK2ESR1ESR2CCNE2
SCHEMBL22280911 0.74 CCNE1 (0.33) CCNE1CDK2ESR1ESR2CCNE2
SCHEMBL20561490 0.73 IKBKB (0.35) CCNE1CDK2ESR1ESR2CCNE2
SCHEMBL22262070 0.72 LMNA (0.35) CCNE1CDK2CCNE2KDM4EMEN1
SCHEMBL839608 0.71 ROCK2 (0.36)

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 CCNE1 3005/4885CDK2 435/4885CASR 3311/4885

“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.