SCHEMBL25877823

SCHEMBL25877823

CC(C)(C)c1cccc(-c2nc(C(C)(C)C)nc3ccccc23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.49
KIF11 P52732 1/20 0.44
ADORA2A P29274 4/20 0.44
NUDT1 P36639 3/20 0.42
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
CDK2 P24941 2/20 0.39
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
CCNE2 O96020 1/20 0.39
CCNE1 P24864 1/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
PLA2G1B P04054 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39

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
SCHEMBL18232159 0.88 ADORA2A (0.46) ABCG2ADORA2ANUDT1CDK2CCNE2
SCHEMBL16520903 0.86 ADORA2A (0.55) ADORA2ANUDT1MAPTMEN1KMT2A
SCHEMBL25877803 0.83 TNKS (0.51) ABCG2ADORA2ANUDT1TNKSTNKS2
SCHEMBL18232171 0.83 ADORA2A (0.51) ADORA2ANUDT1MAPTMEN1KMT2A
SCHEMBL21085589 0.81 ADORA2A (0.66) ABCG2ADORA2AMAPTMEN1KMT2A
SCHEMBL18232158 0.81 ADORA2A (0.42) ADORA2ANUDT1MAPTMEN1KMT2A
SCHEMBL22113578 0.79 ADORA2A (0.40) ADORA2ANUDT1CDK2TNKSTNKS2
SCHEMBL29488281 0.78 ABCG2 (0.53) ABCG2KIF11RXRARXRBTNKS
SCHEMBL600986 0.78 ABCG2 (0.53) ABCG2KIF11RXRARXRBTNKS
SCHEMBL26936075 0.78 ADORA2A (0.39) ADORA2ANUDT1MAPTMEN1KMT2A

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-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 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-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS ACHE, OR51E2, L1CAM ABCG2 1141/4885KIF11 3021/4885ADORA2A 139/4885

“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.