SCHEMBL7059907

SCHEMBL7059907

C(/C=C/c1ccccc1)=C\c1ccccc1.C=CC=C(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.54
CYP3A4 P08684 1/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 2/20 0.42
TRPA1 O75762 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPK1 P28482 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
PLIN1 O60240 1/20 0.41
BCHE P06276 1/20 0.41

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
SCHEMBL7059909 1.00 MAOB (0.54) MAOBCYP3A4LMNAALDH1A1TRPA1
(Z)-1,2-Diphenylethene SCHEMBL9544912 0.92 MAOB (0.44) MAOBLMNAALDH1A1TRPA1HDAC3
(Z)-1,2-Diphenylethene SCHEMBL9544908 0.92 MAOB (0.44) MAOBLMNAALDH1A1TRPA1HDAC3
SCHEMBL57798 0.85 AKT1 (0.46) CYP3A4ALDH1A1MAPK1MAPTRECQL
SCHEMBL28592721 0.84 MAOB (0.58) MAOBCYP3A4LMNAALDH1A1TRPA1
SCHEMBL4595081 0.84 MAOB (0.58) MAOBCYP3A4LMNAALDH1A1TRPA1
SCHEMBL11415300 0.84 MAOB (0.56) MAOBLMNAALDH1A1TRPA1ALOX5
SCHEMBL393155 0.84 MAOB (0.56) MAOBLMNAALDH1A1TRPA1ALOX5
SCHEMBL7935762 0.83 AKT1 (0.44) ALDH1A1MAPK1TSHRESR1CYP19A1
SCHEMBL10555014 0.83 AKT1 (0.44) ALDH1A1MAPK1TSHRESR1CYP19A1

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-20040081829-A1 Sulfonated substantiallly random interpolymer-based absorbent materials KLIER JOHN (US) 2004-04-29 US disclosed