SCHEMBL23843383

SCHEMBL23843383

COC(=O)CCOc1cc(C)c(C)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.53
▸ DYRK1A Q13627 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TSHR P16473 3/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ LTA4H P09960 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39

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
SCHEMBL23843414 0.91 MAPT (0.49) MCL1MAPTALDH1A1LMNAHTT
SCHEMBL15464354 0.88 LMNA (0.51) MCL1DYRK1AMAPTALDH1A1LMNA
SCHEMBL3268733 0.80 LMNA (0.43) MCL1DYRK1AMAPTALDH1A1LMNA
SCHEMBL10738896 0.78 L3MBTL1 (0.68) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL28992827 0.77 MAPT (0.43) MCL1DYRK1AMAPTALDH1A1LMNA
SCHEMBL12908000 0.76 SMN1; SMN2 (0.59) LMNAKMT2AL3MBTL1TDP1HPGD
SCHEMBL28992828 0.76 MAPT (0.43) MCL1MAPTALDH1A1HSD17B10TSHR
SCHEMBL11233455 0.76 MAPT (0.66) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL1811389 0.76 RAB9A (0.59) MAPTALDH1A1LMNAKMT2ATSHR
SCHEMBL1932026 0.74 MAPT (0.53) MAPTALDH1A1LMNAHTTKMT2A

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-2021188392-A1 BORON-CONTAINING CYCLIC EMISSIVE COMPOUNDS AND COLOR CONVERSION FILM CONTAINING THE SAME NITTO DENKO CORPORATION (JP) 2021-09-23 — — WO disclosed
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