SCHEMBL23618334

SCHEMBL23618334

c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4cccc(-c5ccccc5)c34)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.35
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ HCRTR1 O43613 1/20 0.33
▸ MMP12 P39900 1/20 0.33
▸ MMP13 P45452 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PLA2G2A P14555 2/20 0.32
▸ PLA2G4A P47712 2/20 0.32
▸ THRB P10828 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ BLM P54132 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
SCHEMBL23618325 0.96 AHR (0.35) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL24153838 0.95 AHR (0.35) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL26568458 0.93 AHR (0.33) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL26569640 0.93 AHR (0.33) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL23618333 0.93 KDM4E (0.35) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL22837574 0.92 DUSP3 (0.34) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL22837584 0.92 AHR (0.37) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL26585363 0.91 HCRTR1 (0.35) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL22523564 0.91 HCRTR1 (0.37) AHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL24944545 0.91 AHR (0.36) AHRMEN1KMT2AKDM4EALDH1A1

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-2021135542-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2021-07-08 — — WO disclosed
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