SCHEMBL23288258

SCHEMBL23288258

Clc1ccc2sc3cccc4c5cccc6c7ccccc7n(c1c2c34)c56

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
GPR3 P46089 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.31
FTO Q9C0B1 1/20 0.31
RXFP1 Q9HBX9 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
SCHEMBL21454078 0.82 GPR3 (0.38) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL21453520 0.81 GPR3 (0.37) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL23288260 0.81 MAPT (0.39) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL21453653 0.78 GPR3 (0.37) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL23288303 0.78 MAPT (0.39) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL21453478 0.78 GPR3 (0.39) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL23288194 0.77 KDM4E (0.38) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL21454079 0.77 GPR3 (0.40) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL21453523 0.77 GPR3 (0.37) KDM4EMAPTMEN1ALDH1A1POLB
SCHEMBL20071403 0.77 GPR3 (0.38) KDM4EMAPTMEN1ALDH1A1POLB

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-2021080333-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2021-04-29 WO disclosed