SCHEMBL24647652

SCHEMBL24647652

CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)-c3ccc(N(c5ccccc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc3C43c4ccccc4C(C)(C)c4ccccc43)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.39
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 2/20 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 0.31
NR1I2 O75469 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRB1 P08588 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31

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
SCHEMBL25563696 0.99 PDK2 (0.39) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL21559370 0.99 PDK2 (0.39) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL21037597 0.99 PDK2 (0.39) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL25563693 0.99 PDK2 (0.39) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18457640 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18457974 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL21922842 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18457466 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL24905268 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL25563145 0.97 PDK2 (0.40) PDK2KDM4EMAPTALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed