SCHEMBL6853260

SCHEMBL6853260

CC(C)(C)c1ccccc1-c1ccccc1-c1nnoc1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TRPA1 O75762 1/20 0.33
HSD11B1 P28845 1/20 0.33
MAOB P27338 1/20 0.31
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 0.30
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL9786231 0.88 GPR55 (0.34) L3MBTL1MEN1KMT2ATRPA1HSD11B1
SCHEMBL10705944 0.85 GPR55 (0.34) L3MBTL1MEN1KMT2ATRPA1HSD11B1
SCHEMBL73821 0.82 L3MBTL1 (0.36) L3MBTL1MEN1KMT2ATRPA1HSD11B1
SCHEMBL2200421 0.81 GPR55 (0.42) MAOBALDH1A1TSHRNPC1HPGD
SCHEMBL6853263 0.77 L3MBTL1 (0.38) L3MBTL1MEN1KMT2AHSD11B1ALDH1A1
SCHEMBL4051106 0.74 GPR55 (0.42) MAOBALDH1A1TSHRNPC1HPGD
SCHEMBL29872659 0.73 L3MBTL1 (0.49) L3MBTL1MEN1KMT2AALDH1A1TSHR
SCHEMBL9176881 0.73 ALDH1A1 (0.48) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL1175088 0.73 NR4A2 (0.44) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL30721712 0.73 ALDH1A1 (0.43) TRPA1HSD11B1ALDH1A1TSHRHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022030265-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND ORGANIC LIGHT-EMITTING ELEMENT 国立大学法人京都大学 2022-02-10 WO disclosed
WO-2021153168-A1 COMPOUND, LIGHT-EMITTING MATERIAL AND ORGANIC LIGHT-EMITTING ELEMENT 国立大学法人京都大学 2021-08-05 WO disclosed
WO-2021117809-A1 LIGHT-EMITTING MATERIAL, OLED, AND COMPOUND 国立大学法人京都大学 2021-06-17 WO disclosed
US-6777111-B1 HEAT ENDURANCE; LOW CRYSTALLINITY; EMPLOYING CONDENSED RING DERIVATIVE KABUSHIKI KAISHA CHUO KENKYUSHO (JP) 2004-08-17 US disclosed