SCHEMBL17672256

SCHEMBL17672256

CCC(C=CC(N)=O)C=CC(N)=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 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
SCHEMBL9074798 0.81 CHRM1 (0.36) CA1CA2ALDH1A1MAPT
SCHEMBL17183804 0.80 KDM4E (0.39) CA1CA2ALDH1A1MAPTKDM4E
SCHEMBL17183721 0.78
SCHEMBL719805 0.78
SCHEMBL9607828 0.78
SCHEMBL8773155 0.77 GABRP (0.48) ALDH1A1GABRPGABRDGABRA1GABRB1
SCHEMBL28422240 0.77 TGFBR1 (0.32) ALDH1A1
SCHEMBL2206650 0.76 MAPT (0.40) CA1CA2ALDH1A1MAPTDDAH1
SCHEMBL17183666 0.75 ALDH1A1 (0.33) ALDH1A1MAPTGABRPGABRDGABRA1
SCHEMBL15710714 0.75 KDM4E (0.32) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3204436-A1 POLYMER PRODUCT, METHOD FOR PRODUCING THE POLYMER AND USE OF THE POLYMER Kemira OYJ (FI) 2017-08-16 EP claimed
WO-2016055691-A1 POLYMER PRODUCT, METHOD FOR PRODUCING THE POLYMER AND USE OF THE POLYMER KEMIRA OYJ (FI) 2016-04-14 WO claimed