SCHEMBL461353

SCHEMBL461353

NC1=CCC(=O)C=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
SCHEMBL7707431 0.83 MAOA (0.31) MAOAMAOB
SCHEMBL9423400 0.75
SCHEMBL7684525 0.72
SCHEMBL6407297 0.71 CTH (0.31) MAOAMAOB
SCHEMBL9723736 0.71 BACE1 (0.39) MAOAMAOB
SCHEMBL2199751 0.69 MAOA (0.30) MAOAMAOB
SCHEMBL10700502 0.69 MAOA (0.30) MAOAMAOB
SCHEMBL12532851 0.69 TSHR (0.31)
SCHEMBL2193087 0.69 NSD2 (0.32) MAOAMAOB
SCHEMBL497511 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2705036-A1 TRICYCLIC SULFONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC. (US) 2014-03-12 EP disclosed
EP-2595988-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME Zafgen, Inc. (US) 2013-05-29 EP disclosed
WO-2012154678-A1 TRICYCLIC SULFONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-11-15 WO disclosed
WO-2012012642-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-01-26 WO disclosed
US-4369316-A 3,1 Benzoxazine 2,4-dione ICI AMERICAS INC. (US) 1983-01-18 US disclosed
US-4314078-A Process for preparing 5-(2-chloro-4-trifluoromethylphenoxy)-2-nitro-N-alkanesulphonyl benzamides from a benzoic acid derivative and intermediates ICI AMERICAS INC. (US) 1982-02-02 US disclosed