SCHEMBL5245151

SCHEMBL5245151

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.58
HDAC3 O15379 2/20 0.53
HDAC4 P56524 2/20 0.53
HDAC1 Q13547 2/20 0.53
HDAC7 Q8WUI4 2/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC10 Q969S8 2/20 0.53
HDAC11 Q96DB2 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
HDAC9 Q9UKV0 2/20 0.53
HDAC5 Q9UQL6 2/20 0.53
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
TRPA1 O75762 1/20 0.45
ALOX5 P09917 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 2/20 0.45
MAPT P10636 2/20 0.45

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
SCHEMBL27486273 1.00 MAOB (0.58) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL8526840 0.82 FOS (0.47) MAOBALDH1A1LMNAALOX5MAPT
SCHEMBL546104 0.82 MAPT (0.56) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL27472622 0.79 ALDH1A1 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10980373 0.79 ALDH1A1 (0.45) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL23457944 0.79 MAOB (0.93) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL8927957 0.79 MAOB (0.93) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL29919697 0.79 MAOB (0.93) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL17312322 0.79 MAOB (0.93) MAOBHDAC3HDAC4HDAC1HDAC7
SCHEMBL250402 0.79 MAOB (0.93) MAOBHDAC3HDAC4HDAC1HDAC7

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
EP-1369463-B1 Adhesive composition UHU GMBH & CO KG (DE) 2007-09-12 EP claimed
EP-0522233-B1 Impact resistant graft copolymers HIMONT INC (US) 1995-06-07 EP claimed