SCHEMBL6035252

SCHEMBL6035252

O=S(=O)=C1C=CCc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.34
CES1 P23141 2/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAOB P27338 3/20 0.32
BCHE P06276 1/20 0.32
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ACHE P22303 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2A6 P11509 1/20 0.31
IDO1 P14902 1/20 0.30
CDC25B P30305 1/20 0.30
AKT1 P31749 1/20 0.30
SNCA P37840 1/20 0.30
MAP2K1 Q02750 1/20 0.30
PIN1 Q13526 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
NSD1 Q96L73 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30

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
SCHEMBL50865 0.72 MAOA (0.50) MAOACES1CA1CA2MAOB
SCHEMBL30252635 0.72 MAOA (0.50) MAOACES1CA1CA2MAOB
Hydrochloric Acid SCHEMBL2710069 0.71 MAOA (0.48) MAOACES1CA1CA2MAOB
Hydrochloric Acid SCHEMBL30537100 0.71 MAOA (0.48) MAOACES1CA1CA2MAOB
SCHEMBL596017 0.70 CA1 (0.37) MAOACES1CA1CA2MAOB
SCHEMBL21247727 0.69 MAOA (0.40) MAOACES1CA1CA2MAOB
SCHEMBL9733032 0.68 CA1 (0.40) MAOACES1CA1CA2MAOB
SCHEMBL10702241 0.68 CA1 (0.36) MAOACES1CA1CA2MAOB
SCHEMBL251162 0.68 CA1 (0.36) MAOACES1CA1CA2MAOB
SCHEMBL3743020 0.68 CA1 (0.36) MAOACES1CA1CA2MAOB

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-7134466-B2 Crosslinked rubber particles modified by amino(meth)acrylate groups BAYER AKTIENGESELLSCHAFT (DE) 2006-11-14 US disclosed
US-20040166317-A1 Crosslinked rubber particles modified by amino(meth)acrylate groups ARLANXEO DEUTSCHLAND GMBH (DE) 2004-08-26 US disclosed
US-5068342-A Hypoglycemic agents and antidiabetic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-26 US disclosed
US-4997948-A Hypoglycemic agents AMERICAN HOME PRODUCTS (US) 1991-03-05 US disclosed