SCHEMBL8948291

SCHEMBL8948291

C=C(C)C(=O)NC([Na])CC

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.47
RXFP1 Q9HBX9 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL11674951 0.77 TGFBR1 (0.50) TGFBR1RXFP1ALDH1A1
SCHEMBL15322737 0.77 TGFBR1 (0.50) TGFBR1RXFP1ALDH1A1
SCHEMBL154480 0.77 TGFBR1 (0.50) TGFBR1RXFP1ALDH1A1
SCHEMBL28103168 0.76 TGFBR1 (0.48) TGFBR1RXFP1ALDH1A1
SCHEMBL554944 0.76 TGFBR1 (0.48) TGFBR1RXFP1ALDH1A1
SCHEMBL340694 0.74 TGFBR1 (0.47) TGFBR1RXFP1ALDH1A1
SCHEMBL9948913 0.74 TGFBR1 (0.47) TGFBR1RXFP1ALDH1A1
SCHEMBL16530706 0.74 TGFBR1 (0.47) TGFBR1RXFP1ALDH1A1
SCHEMBL9798532 0.74 TGFBR1 (0.47) TGFBR1RXFP1ALDH1A1
SCHEMBL2487819 0.74 TGFBR1 (0.50) TGFBR1RXFP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5501903-A Magnetic recording medium having a binder system including a non halogenated vinyl polymer and a polyurethane polymer each with specified pendant groups MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-03-26 US disclosed