SCHEMBL961664

SCHEMBL961664

CC(C)N(c1ccccc1C(=O)NN)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
ALDH1A1 P00352 5/20 0.45
P2RX7 Q99572 1/20 0.45
KMT2A Q03164 7/20 0.44
MEN1 O00255 5/20 0.44
MAPT P10636 3/20 0.42
GAA P10253 2/20 0.42
MITF O75030 1/20 0.42
NCOA1 Q15788 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL962276 0.81 ALDH1A1 (0.62) CTSDCA1CA2CA9ALDH1A1
SCHEMBL959908 0.79 CTSD (0.50) CTSDCA1CA2CA9ALDH1A1
SCHEMBL10921933 0.78 CTSD (0.49) CTSDCA1CA2CA9ALDH1A1
SCHEMBL14150723 0.77 ALDH1A1 (0.52) CA1CA2CA9ALDH1A1MAPT
SCHEMBL959111 0.76 CTSD (0.47) CTSDCA1CA2CA9ALDH1A1
SCHEMBL30547074 0.76 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL239328 0.76 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL24480200 0.76 CTSD (0.55) CTSDCA1CA2CA9ALDH1A1
Methylglyoxal SCHEMBL2956982 0.75 CTSD (0.40) CTSDCA1CA2CA9ALDH1A1
Lithium Ion SCHEMBL31633774 0.74 ALDH1A1 (0.44) CA2ALDH1A1KMT2AMEN1MAPT

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-2248833-B1 MODIFIED DIENE RUBBER, METHOD FOR PRODUCING THE SAME, RUBBER COMPOSITION USING THE SAME, AND TIRE BRIDGESTONE CORP (JP) 2014-03-26 EP disclosed
US-8389641-B2 Modified diene rubber, production method thereof, and rubber composition and tire using the rubber BRIDGESTONE CORPORATION (JP) 2013-03-05 US disclosed
US-20110003911-A1 MODIFIED DIENE RUBBER, PRODUCTION METHOD THEREOF, AND RUBBER COMPOSITION AND TIRE USING THE RUBBER BRIDGESTONE CORPORATION (JP) 2011-01-06 US disclosed
EP-2248833-A1 MODIFIED DIENE RUBBER, METHOD FOR PRODUCING THE SAME, RUBBER COMPOSITION USING THE SAME, AND TIRE Bridgestone Corporation (JP) 2010-11-10 EP disclosed
US-20100249336-A1 MODIFIED NATURAL RUBBER AND METHOD FOR PRODUCING SAME, AND RUBBER COMPOSITION AND TIRE USING SUCH A MODIFIED NATURAL RUBBER BRIDGESTONE CORPORATION (JP) 2010-09-30 US disclosed
EP-2206730-A1 MODIFIED NATURAL RUBBER, PROCESS FOR PRODUCTION OF THE SAME, AND RUBBER COMPOSITION AND TIRE EACH COMPRISING THE SAME Bridgestone Corporation (JP) 2010-07-14 EP disclosed