SCHEMBL25657128

SCHEMBL25657128

C=Cc1ccc2c(c1)C(C)(C)c1cc(Nc3ccccc3)ccc1-2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.45
APP P05067 1/20 0.39
ALDH1A1 P00352 8/20 0.38
MEN1 O00255 4/20 0.38
MAPT P10636 4/20 0.38
KMT2A Q03164 4/20 0.38
AR P10275 1/20 0.38
HSD17B10 Q99714 5/20 0.37
L3MBTL1 Q9Y468 5/20 0.37
ALOX12 P18054 5/20 0.37
TSHR P16473 4/20 0.37
ALOX15 P16050 4/20 0.37
MAPK1 P28482 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
PTGS1 P23219 1/20 0.37
SLC6A2 P23975 1/20 0.37
PTGS2 P35354 1/20 0.37
HTR2B P41595 1/20 0.37
CYP3A4 P08684 4/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL19954774 0.86 PDK2 (0.55) PDK2APPALDH1A1MEN1MAPT
SCHEMBL25657125 0.85 PDK2 (0.42) PDK2APPALDH1A1TSHRSLC6A2
SCHEMBL10042621 0.84 PDK2 (0.46) PDK2APPALDH1A1MEN1MAPT
SCHEMBL30745201 0.82 PDK2 (0.59) PDK2APPALDH1A1MEN1MAPT
SCHEMBL29405352 0.82 PDK2 (0.59) PDK2APPALDH1A1MEN1MAPT
SCHEMBL783000 0.82 PDK2 (0.59) PDK2APPALDH1A1MEN1MAPT
Diphenylamine SCHEMBL28311688 0.82 PDK2 (0.59) PDK2APPALDH1A1MEN1MAPT
SCHEMBL17201467 0.81 ALK (0.43) PDK2ALDH1A1MAPTTSHRTDP1
SCHEMBL18311923 0.80 PDK2 (0.39) PDK2APPALDH1A1MEN1MAPT
SCHEMBL1477667 0.80 PDK2 (0.41) PDK2ALDH1A1TSHRTDP1SLC6A2

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-20230146776-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-05-11 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-20230146776-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF PIEZO1, EED, ACHE PDK2 1171/4885APP 702/4885ALDH1A1 971/4885

“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.