SCHEMBL5572948

SCHEMBL5572948

C[C]C=Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
CYP19A1 P11511 2/20 0.48
MAOA P21397 2/20 0.48
CHAT P28329 2/20 0.44
TRPA1 O75762 2/20 0.43
RELA Q04206 1/20 0.43
GLA P06280 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
NFE2L2 Q16236 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPK1 P28482 1/20 0.42
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 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
SCHEMBL9119896 0.78 MAOB (0.55) MAOBCYP19A1MAOACHATTRPA1
SCHEMBL11156498 0.75 APP (0.54) MAOBCYP19A1MAOATRPA1RELA
SCHEMBL27750955 0.75 MAOB (0.46) MAOBCYP19A1MAOACHATTRPA1
SCHEMBL27299321 0.75 MAOB (0.46) MAOBCYP19A1MAOACHATTRPA1
SCHEMBL7109627 0.74 MAOB (0.50) MAOBCYP19A1MAOACHATTRPA1
SCHEMBL7109623 0.74 MAOB (0.50) MAOBCYP19A1MAOACHATTRPA1
SCHEMBL6834934 0.74 MAOB (0.50) MAOBCYP19A1MAOATRPA1GLA
SCHEMBL27745 0.74 MAOB (0.50) MAOBCYP19A1MAOATRPA1GLA
SCHEMBL3802508 0.74 MAOB (0.50) MAOBCYP19A1MAOACHATTRPA1
Cinnamonitrile SCHEMBL23599 0.74 KDM4E (0.54) MAOBCYP19A1MAOACHATTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1860129-A1 Soft propylene-based resin composition Mitsubishi Chemical Corporation (JP) 2007-11-28 EP disclosed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO disclosed
US-5422360-A Hydrazonoimidazolidin-4-one derivatives; treatment of diabetes and aging disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-06-06 US disclosed
EP-0531812-A1 Maillard reaction inhibitor, process for producing it, composition containing it and the use thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-03-17 EP disclosed