SCHEMBL11548255

SCHEMBL11548255

C(=Cc1ccc(-c2ccc(-c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
MGLL Q99685 1/20 0.60
MAOB P27338 2/20 0.59
NFE2L2 Q16236 1/20 0.59
CYP19A1 P11511 1/20 0.59
MAOA P21397 1/20 0.59
HDAC2 Q92769 2/20 0.54
ALDH1A1 P00352 1/20 0.53
RELA Q04206 3/20 0.52
TRPA1 O75762 1/20 0.52
HDAC1 Q13547 2/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.48
CHAT P28329 1/20 0.48
CHEK1 O14757 1/20 0.47

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
SCHEMBL11548251 1.00 CA1 (0.60) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL4004894 1.00 CA1 (0.60) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL4004892 1.00 CA1 (0.60) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL83379 0.97 MAOB (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL76158 0.97 CA1 (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL11548871 0.97 MAOB (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL83380 0.97 MAOB (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL11548873 0.97 MAOB (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL76159 0.97 CA1 (0.62) CA1MGLLMAOBNFE2L2CYP19A1
SCHEMBL9171323 0.97 CA1 (0.62) CA1MGLLMAOBNFE2L2CYP19A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4158099-A FROM SCHIFF BASES AND BIPHENYL COMPOUND CIBA-GEIGY AG (CH) 1979-06-12 US disclosed
US-3991049-A Aromatic compounds containing ethylene double bonds, processes for their manufacture and use CIBA-GEIGY AG (CH) 1976-11-09 US disclosed