SCHEMBL4564656

SCHEMBL4564656

C=CCNS(=O)(=O)c1ccccc1CC=C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CA12 O43570 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 2/20 0.36
MITF O75030 1/20 0.36
NSD2 O96028 1/20 0.36
LMNA P02545 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36

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
SCHEMBL4761072 0.85 KDM4E (0.43) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL4790234 0.85 CA12 (0.52) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL8605185 0.81 GABRA1 (0.37) KDM4ECYP2C9CA12ALDH1A1GABRA1
SCHEMBL8208785 0.78 MAPK1 (0.44) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL636219 0.78 POLB (0.44) KDM4ECYP2D6ALDH1A1KMT2AGABRA1
SCHEMBL4827254 0.78 CYP1A2 (0.39) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL16831449 0.78 RECQL (0.53) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL253350 0.78 CYP2C9 (0.48) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL11667123 0.78 KDM4E (0.54) KDM4ECYP1A2CYP2D6CYP2C9CASP1
SCHEMBL10616445 0.78 KDM4E (0.45) KDM4ECYP1A2CYP2D6CYP2C9CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455578-B2 Particulate polyamide, plasticizer capable of hydrogen-bonding, and binder AVERY DENNISON CORPORATION (US) 2013-06-04 US claimed
EP-2094797-A1 INK-RECEPTIVE COATING COMPOSITION Avery Dennison Corporation (US) 2009-09-02 EP claimed
US-20080188599-A1 Ink-receptive coating composition CCL LABEL, INC. 2008-08-07 US claimed
WO-2008070029-A1 INK-RECEPTIVE COATING COMPOSITION AVERY DENNISON CORPORATION (US) 2008-06-12 WO claimed
US-8455578-B2 Particulate polyamide, plasticizer capable of hydrogen-bonding, and binder AVERY DENNISON CORPORATION (US) 2013-06-04 US disclosed
EP-2094797-A1 INK-RECEPTIVE COATING COMPOSITION Avery Dennison Corporation (US) 2009-09-02 EP disclosed
US-20080188599-A1 Ink-receptive coating composition CCL LABEL, INC. 2008-08-07 US disclosed
WO-2008070029-A1 INK-RECEPTIVE COATING COMPOSITION AVERY DENNISON CORPORATION (US) 2008-06-12 WO disclosed