SCHEMBL20707495

SCHEMBL20707495

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 14/20 0.42
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MLNR O43193 1/20 0.34
NR1I2 O75469 1/20 0.34
CHRM2 P08172 1/20 0.34
ADRB1 P08588 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
CHRM1 P11229 1/20 0.34
DRD2 P14416 1/20 0.34
ADRA2B P18089 1/20 0.34

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
SCHEMBL15081595 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL16158299 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL15081579 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL14270744 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL18926277 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL29416701 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL15138534 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL14036996 1.00 PDK2 (0.42) PDK2L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL24904897 0.98 PDK2 (0.41) PDK2L3MBTL1MAPTMLNRNR1I2
SCHEMBL14270756 0.98 PDK2 (0.41) PDK2L3MBTL1MAPTMLNRNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
EP-3439062-B1 ORGANIC LIGHT EMITTING ELEMENT LG CHEMICAL LTD (KR) 2021-09-08 EP disclosed
US-20190148650-A1 Organic Light Emitting Device LG CHEM, LTD. (KR) 2019-05-16 US disclosed
EP-3439062-A1 ORGANIC LIGHT EMITTING ELEMENT LG Chem, Ltd. (KR) 2019-02-06 EP disclosed