SCHEMBL25878168

SCHEMBL25878168

CC(C)(C)c1cnc2c(ccc3ccncc32)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.45
DYRK1A Q13627 1/20 0.45
MAPK10 P53779 7/20 0.37
CCR1 P32246 2/20 0.35
CCR5 P51681 2/20 0.35
CCR8 P51685 2/20 0.35
KIF11 P52732 3/20 0.34
MAOA P21397 2/20 0.34
HIPK2 Q9H2X6 1/20 0.34
LATS1 O95835 1/20 0.33
LATS2 Q9NRM7 1/20 0.33
TNF P01375 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
RAD52 P43351 1/20 0.33
TDO2 P48775 1/20 0.32

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
SCHEMBL14327674 0.80 CCR1 (0.52) CCR1CCR5CCR8KIF11KDM4E
SCHEMBL13619364 0.78 HPGDS (0.43) CLK1DYRK1AMAPK10KIF11LATS1
SCHEMBL23625967 0.75 CLK1 (0.49) CLK1DYRK1AMAPK10CCR1CCR5
SCHEMBL24109187 0.75 CYP3A4 (0.35) CCR1CCR5CCR8KDM4E
SCHEMBL25054661 0.74 CLK1 (0.45) CLK1DYRK1AMAPK10CCR1CCR5
SCHEMBL12354247 0.73 CCR1 (0.62) CCR1CCR5CCR8KDM4EHTT
SCHEMBL30492662 0.73 CCR1 (0.62) CCR1CCR5CCR8KDM4EHTT
SCHEMBL13619365 0.73 NOS3 (0.35) CCR1CCR5CCR8KDM4E
SCHEMBL10249921 0.73 KIF11 (0.38) CLK1DYRK1AKIF11LATS1LATS2
SCHEMBL26144287 0.73 MAOA (0.41) KIF11MAOAHIPK2LATS1LATS2

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 2 patents. 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
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 CLK1 1998/4885DYRK1A 2942/4885MAPK10 3163/4885

“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.