SCHEMBL19621925

SCHEMBL19621925

CCCCCCCCc1ccc2c(c1)c(CC)c(F)c1cc(Br)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.38
PPARA Q07869 1/20 0.38
RORA P35398 1/20 0.38
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
ESR1 P03372 3/20 0.37
ESR2 Q92731 1/20 0.37
HTR1A P08908 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
NFKB1 P19838 1/20 0.37
RAB9A P51151 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRA2A P08913 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
TACR2 P21452 2/20 0.36

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
SCHEMBL7610928 0.90 KAT8 (0.42) KAT8PPARARORARORCRORB
SCHEMBL7607424 0.90 KAT8 (0.42) KAT8PPARARORARORCRORB
SCHEMBL7606851 0.84 NPC1 (0.46) KAT8HTR1ANPC1GAANFKB1
SCHEMBL7611678 0.81 KAT8 (0.49) KAT8PPARARORARORCRORB
SCHEMBL7607203 0.81 KAT8 (0.49) KAT8PPARARORARORCRORB
SCHEMBL27955065 0.81 PTGS2 (0.48) KAT8PPARARORARORCRORB
SCHEMBL17878901 0.78 SRC (0.40) ESR1ESR2ADRA2AADORA3TACR2
SCHEMBL1893401 0.78 SRC (0.40) ESR1ESR2ADRA2AADORA3TACR2
SCHEMBL7523369 0.75 EIF4A1 (0.41) RORARORCRORBESR1HTR1A
SCHEMBL19767756 0.75 SRC (0.38) ESR1ESR2ADRA2AADORA3TACR2

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-2669263-B1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-22 EP disclosed