SCHEMBL22920747

SCHEMBL22920747

CC1(C)c2cc(Cl)ccc2-c2c1ccc1sc3ccccc3c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
DUSP3 P51452 1/20 0.39
BLM P54132 1/20 0.39
PTPN5 P54829 1/20 0.39
KMT2A Q03164 1/20 0.39
PTPN11 Q06124 1/20 0.39
MCL1 Q07820 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
IDO1 P14902 1/20 0.33
ALDH1A1 P00352 2/20 0.33
JAK2 O60674 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
GPR3 P46089 1/20 0.33
ALK Q9UM73 1/20 0.32
CHEK1 O14757 1/20 0.32

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
SCHEMBL22920954 0.86 PGR (0.34) KDM4EIDO1CHEK1WEE1CYP1A2
SCHEMBL22920683 0.86 KDM4E (0.41) KDM4EMAPTTDP1MEN1POLB
SCHEMBL24557147 0.84 MAPT (0.44) KDM4EMAPTTDP1MEN1POLB
SCHEMBL18034440 0.82 KDM4E (0.42) KDM4EMAPTTDP1MEN1POLB
SCHEMBL10108824 0.82 KDM4E (0.38) KDM4EMAPTIDO1ALDH1A1JAK2
SCHEMBL30761905 0.82 KDM4E (0.38) KDM4EMAPTIDO1ALDH1A1JAK2
SCHEMBL18732418 0.81 KDM4E (0.41) KDM4EMAPTTDP1MEN1POLB
SCHEMBL23743414 0.81 MEN1 (0.36) MAPTTDP1MEN1POLBDUSP3
SCHEMBL17944353 0.81 MEN1 (0.36) MAPTTDP1MEN1POLBDUSP3
SCHEMBL18034433 0.80 KDM4E (0.38) KDM4EMAPTTDP1MEN1POLB

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-2021015555-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-01-28 WO disclosed