SCHEMBL21037256

SCHEMBL21037256

c1ccc(N(c2ccccc2)c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4c3-c3ccccc3C43c4ccccc4C(c4ccccc4)(c4ccccc4)c4ccccc43)cc2)cc1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL17855416 0.95 AHR (0.34) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL21037263 0.94 AHR (0.31) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL18457973 0.94 AHR (0.35) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL25472844 0.93 AHR (0.33) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL18457470 0.93 AHR (0.34) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL25145482 0.92 AHR (0.31) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL25472825 0.92 KDM4E (0.33) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL25145373 0.92 AHR (0.31) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL21141188 0.92 AHR (0.32) AHRKDM4EMEN1ALDH1A1MAPT
SCHEMBL23383226 0.92 AHR (0.32) AHRKDM4EMEN1ALDH1A1MAPT

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-2019103397-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2019-05-31 WO disclosed