SCHEMBL7707431

SCHEMBL7707431

NC1=CC(=O)CC=C1C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL461353 0.83 MAOA (0.31) MAOAMAOB
SCHEMBL6407297 0.75 CTH (0.31) MAOAMAOB
SCHEMBL2199751 0.73 MAOA (0.30) MAOAMAOB
SCHEMBL10700502 0.73 MAOA (0.30) MAOAMAOB
SCHEMBL7684525 0.72
SCHEMBL11878757 0.71
SCHEMBL497511 0.71
SCHEMBL12532851 0.69 TSHR (0.31)
SCHEMBL2193087 0.69 NSD2 (0.32) MAOAMAOB
SCHEMBL6405393 0.68 HCAR2 (0.30)

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
US-6355743-B1 COMPLEXING IRON WITH OXYCARBOXYLIC ACID CHELATE COMPOUND; ANTISCALING OF INTERIOR WALLS OF BAFFLE VESSELS; DISCOLORATION INHIBITION; ADDITION POLYMERIZATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-03-12 US disclosed
EP-0805168-B1 Vinyl chloride polymer SHINETSU CHEMICAL CO (JP) 2000-11-08 EP disclosed
US-6022932-A CAN EFFECTIVELY PREVENT POLYMER SCALES FROM ADHERING TO THE INNER SURFACES OF THE POLYMERIZATION VESSEL SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-02-08 US disclosed
EP-0805168-A1 Vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1997-11-05 EP disclosed