SCHEMBL21166976

SCHEMBL21166976

COc1cc(OC)c(-c2ccc(C(C)(C)C)cc2)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
TDO2 P48775 1/20 0.41
MAPT P10636 4/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 3/20 0.40
MAPK1 P28482 2/20 0.40
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL28603353 0.82 CA12 (0.54) ALDH1A1CYP1A2CYP3A4CA1CA2
SCHEMBL1623583 0.81 MAPT (0.45) ALDH1A1CYP3A4TDO2MAPTCA1
SCHEMBL1623731 0.79 CYP1A1 (0.59) CYP1A2CYP3A4MAPTCA1CA2
SCHEMBL1047654 0.79 ACHE (0.50) ALDH1A1CYP1A2CYP3A4MAPTCA1
SCHEMBL12549065 0.77 ABL1 (0.62) MAPTMEN1KMT2AMAPK1ABL1
SCHEMBL5541288 0.77 CYP1A2 (0.44) ALDH1A1CYP1A2CYP3A4MAPTCA1
SCHEMBL7144898 0.77 TDP1 (0.52) ALDH1A1CYP1A2CYP3A4MAPTCA1
SCHEMBL17924581 0.76 SMN1; SMN2 (0.54) ALDH1A1CYP1A2CYP3A4MAPTCA1
SCHEMBL2608411 0.76 MAPT (0.58) ALDH1A1MAPTCA1CA2CA12
SCHEMBL21167030 0.74 CYP2D6 (0.47) ALDH1A1CYP1A2CYP3A4CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3670610-B1 COATING COMPOSITION, ORGANIC LIGHT-EMITTING DIODE USING SAME, AND METHOD FOR PREPARING SAME LG CHEMICAL LTD (KR) 2023-01-25 EP disclosed
EP-3540015-B1 USE OF A COATING COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2023-01-18 EP disclosed
EP-3524646-B1 IONIC COMPOUND, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT-EMITTING DIODE LG CHEMICAL LTD (KR) 2021-07-21 EP disclosed
EP-3670610-A1 COATING COMPOSITION, ORGANIC LIGHT-EMITTING DIODE USING SAME, AND METHOD FOR PREPARING SAME LG CHEM, LTD. (KR) 2020-06-24 EP disclosed
EP-3511382-B1 ORGANIC LIGHT-EMITTING DIODE LG CHEMICAL LTD (KR) 2020-04-29 EP disclosed
EP-3540015-A2 COATING COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2019-09-18 EP disclosed
EP-3524646-A1 IONIC COMPOUND, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT-EMITTING DIODE LG Chem, Ltd. (KR) 2019-08-14 EP disclosed
EP-3511382-A1 ORGANIC LIGHT-EMITTING DIODE LG Chem, Ltd. (KR) 2019-07-17 EP disclosed