SCHEMBL5608312

SCHEMBL5608312

C=C(CC=Cc1ccccc1)C(=O)OC(=O)C(=C)CC=Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.59
MAOB P27338 4/20 0.50
IDO1 P14902 2/20 0.42
MAOA P21397 3/20 0.41
HDAC1 Q13547 2/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 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
SCHEMBL27901586 0.88 PAM (0.58) PAMMAOBIDO1MAOAHDAC1
SCHEMBL96726 0.87 PAM (0.56) PAMMAOBMAOAHDAC1LMNA
SCHEMBL9244122 0.85 PAM (0.54) PAMMAOBIDO1MAOAHDAC1
SCHEMBL1792779 0.84 MEN1 (0.55) PAMMAOBMAOALMNAALDH1A1
SCHEMBL16463 0.84 PAM (0.66) PAMMAOBIDO1MAOAHDAC1
Benzene SCHEMBL27612926 0.84 PAM (0.66) PAMMAOBIDO1MAOAHDAC1
SCHEMBL278485 0.84 PAM (0.66) PAMMAOBIDO1MAOAHDAC1
SCHEMBL409074 0.83 PAM (0.51) PAMMAOBIDO1MAOAHDAC1
SCHEMBL3382895 0.83 LMNA (0.55) PAMMAOBLMNAALDH1A1HCAR2
SCHEMBL10535877 0.83 PAM (0.51) PAMMAOBIDO1MAOAHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101128542-A Polymer blends 3M INNOVATIVE PROPERTIES CO (US) 2008-02-20 CN claimed
EP-1856209-A1 POLYMER BLENDS 3M Innovative Properties Company (US) 2007-11-21 EP claimed
WO-2006091768-A1 POLYMER BLENDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-31 WO claimed
US-20060189756-A1 POLYMER BLENDS 3M INNOVATIVE PROPERTIES COMPANY 2006-08-24 US claimed
CN-101128542-A Polymer blends 3M INNOVATIVE PROPERTIES CO (US) 2008-02-20 CN disclosed
EP-1856209-A1 POLYMER BLENDS 3M Innovative Properties Company (US) 2007-11-21 EP disclosed
WO-2006091768-A1 POLYMER BLENDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-31 WO disclosed
US-20060189756-A1 POLYMER BLENDS 3M INNOVATIVE PROPERTIES COMPANY 2006-08-24 US disclosed