SCHEMBL16016283

SCHEMBL16016283

Clc1cc(C2=CC=CCC2)cc(-c2nc(-c3cc(Cl)cc(-c4ccccc4)c3)nc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)n2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.34
RXRB P28702 2/20 0.34
LMNA P02545 1/20 0.32
CTRC Q99895 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
NR1I3 Q14994 1/20 0.31
DPP4 P27487 1/20 0.31
ABCG2 Q9UNQ0 2/20 0.30
PDE5A O76074 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
CETP P11597 1/20 0.30
ABCB1 P08183 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
SCHEMBL21845645 0.86 MEN1 (0.37) LMNAADORA2AADORA1MEN1KMT2A
SCHEMBL25944768 0.85 MEN1 (0.33) LMNAHTTMEN1KMT2AABCG2
SCHEMBL23312802 0.83 ALDH1A1 (0.35) LMNAHTTMEN1KMT2AHRH4
SCHEMBL24273020 0.82 MEN1 (0.37) LMNACTRCADORA2AADORA2BADORA1
SCHEMBL24408545 0.82 KMO (0.37) LMNAADORA2AADORA2BADORA1MEN1
SCHEMBL17379751 0.81 MEN1 (0.36) LMNAHTTMEN1KMT2AHRH4
SCHEMBL15871221 0.81 KMT2A (0.50) LMNACTRCADORA2AADORA1MEN1
SCHEMBL23640992 0.80 RAB9A (0.38) LMNAMEN1KMT2ANPC1MAPK1
SCHEMBL24727410 0.80 MEN1 (0.38) LMNAADORA2AADORA2BADORA1HTT
SCHEMBL23597578 0.80 ALDH1A1 (0.35) LMNAHTTMEN1KMT2AHRH4

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
EP-2361909-B1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME TOSOH CORP (JP) 2014-09-10 EP disclosed