SCHEMBL23770461

SCHEMBL23770461

CC1(C)c2ccccc2-c2c(-c3nc(-c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)nc(-c4cccc(-c5cccnc5)c4)n3)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.36
PIM1 P11309 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
USP1 O94782 5/20 0.33
WDR48 Q8TAF3 5/20 0.33
MAPK10 P53779 1/20 0.33
CYP11B1 P15538 2/20 0.33
PIK3CD O00329 1/20 0.33
PIP5K1C O60331 1/20 0.33
PIK3CA P42336 1/20 0.33
PI4KA P42356 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP11B2 P19099 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 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
SCHEMBL23770370 0.91 ALOX5 (0.39) PDK2PIM1PIM2USP1WDR48
SCHEMBL23770505 0.90 PIM3 (0.36) PIM1PIM2CYP1A2
SCHEMBL18463594 0.90 PIM3 (0.33) ALDH1A1CYP1A2MAPT
SCHEMBL22987011 0.89 SLC9A1 (0.34) ALDH1A1CYP1A2MAPT
SCHEMBL22038354 0.88 PDK2 (0.43) PDK2USP1WDR48CYP11B1CYP17A1
SCHEMBL23770492 0.87 PDK2 (0.37) PDK2PIM1PIM2USP1WDR48
SCHEMBL19165278 0.86 PDK2 (0.41) PDK2PIM1PIM2USP1WDR48
SCHEMBL19039172 0.86 PIM3 (0.33) ALDH1A1MEN1CYP1A2GLAKMT2A
SCHEMBL23770398 0.86 F9 (0.33) PIK3CAPI4KAPI4KBALDH1A1BACE1
SCHEMBL19165920 0.86 PDK2 (0.41) PDK2PIM1PIM2USP1WDR48

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-20230123170-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND IDEMITSU KOSAN CO.,LTD. (JP) 2023-04-20 US disclosed
WO-2021162122-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2021-08-19 WO 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-20230123170-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND L1CAM, LEF1, CCNL2 PDK2 2289/4885PIM1 1586/4885PIM2 1845/4885

“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.