SCHEMBL22182457

SCHEMBL22182457

CC1(C)c2ccccc2-c2cccc(-c3cccc(Nc4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.41
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ AR P10275 1/20 0.32
▸ F11 P03951 3/20 0.32
▸ F7 P08709 3/20 0.32
▸ F10 P00742 2/20 0.32
▸ APP P05067 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ALOX5 P09917 1/20 0.30
▸ PGR P06401 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
SCHEMBL23696867 0.87 PDK2 (0.42) PDK2MEN1KMT2APOLBMAPT
SCHEMBL24968679 0.86 PDK2 (0.39) PDK2MEN1KMT2APOLB
SCHEMBL15677718 0.86 PDK2 (0.48) PDK2MEN1KMT2APOLBMAPT
SCHEMBL29907923 0.86 PDK2 (0.48) PDK2MEN1KMT2APOLBMAPT
SCHEMBL22001169 0.86 MAPT (0.44) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL22182366 0.86 PDK2 (0.39) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL21615065 0.85 PDK2 (0.44) PDK2MEN1KMT2AMAPTKDM4E
SCHEMBL29874813 0.85 PDK2 (0.46) PDK2MEN1KMT2APOLBMAPT
SCHEMBL16596683 0.85 PDK2 (0.46) PDK2MEN1KMT2APOLBMAPT
SCHEMBL29440301 0.85 PDK2 (0.46) PDK2MEN1KMT2APOLBMAPT

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
WO-2020138837-A1 COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE 엘티소재주식회사 2020-07-02 — — WO disclosed
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