SCHEMBL22868826

SCHEMBL22868826

c1ccc(-c2nc(-c3cccc(-c4ccccc4-c4cccc5c6c(ccc45)-c4ccccc4C6(c4ccccc4)c4ccccc4)c3)nc(-c3ccc4ccccc4c3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ PIM1 P11309 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ ATM Q13315 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
SCHEMBL22868844 0.93 MAPT (0.34) KDM4ESMN1; SMN2ALDH1A1TP53HSD17B10
SCHEMBL22868948 0.92 ALDH1A1 (0.36) METKDM4ESMN1; SMN2ALDH1A1TP53
SCHEMBL22869067 0.90 MET (0.35) METKDM4ESMN1; SMN2ALDH1A1TP53
SCHEMBL22868711 0.90 KDM4E (0.33) METKDM4ESMN1; SMN2ALDH1A1TP53
SCHEMBL22868877 0.89 MEN1 (0.36) KDM4ESMN1; SMN2ALDH1A1TP53HSD17B10
SCHEMBL22868793 0.88 ALDH1A1 (0.37) METKDM4ESMN1; SMN2ALDH1A1TP53
SCHEMBL22868697 0.88 MEN1 (0.35) KDM4ESMN1; SMN2ALDH1A1TP53HSD17B10
SCHEMBL22868608 0.87 PDK2 (0.34) KDM4ESMN1; SMN2ALDH1A1TP53HSD17B10
SCHEMBL22868694 0.87 PDK2 (0.34) KDM4ESMN1; SMN2ALDH1A1TP53HSD17B10
SCHEMBL22059126 0.86 KDM4E (0.37) METKDM4ESMN1; SMN2ALDH1A1TP53

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
US-20210005822-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-01-07 — — US disclosed
Send feedback