SCHEMBL23723201

SCHEMBL23723201

Clc1ccc2c(c1)c1cccc3c1n2c1cccc2c4ccccc4n3c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
KDM4E B2RXH2 5/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.44
TP53 P04637 3/20 0.38
ALKBH5 Q6P6C2 1/20 0.37
FTO Q9C0B1 1/20 0.37
HCRTR1 O43613 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
USP2 O75604 1/20 0.35
PSEN1 P49768 1/20 0.34
PSEN2 P49810 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
SCHEMBL19387982 0.95 MAPT (0.49) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL23728960 0.88 MAPT (0.39) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL29783091 0.84 MAPT (0.49) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL17133804 0.84 MAPT (0.49) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL15434837 0.82 ALKBH5 (0.48) MAPTKDM4EL3MBTL1MEN1KMT2A
SCHEMBL24034725 0.82 ALKBH5 (0.48) MAPTKDM4EL3MBTL1MEN1KMT2A
SCHEMBL22954842 0.82 CYP1A2 (0.41) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL23728965 0.82 MAPT (0.40) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL23723208 0.81 KDM4E (0.38) MAPTKDM4EL3MBTL1TSHRALOX12
SCHEMBL26308915 0.80 ALKBH5 (0.47) MAPTKDM4EL3MBTL1MEN1KMT2A

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-2021153931-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-05 WO disclosed