SCHEMBL7620717

SCHEMBL7620717

C=C(C)C(=O)NCCCCCNCCC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.63
EPHX1 P07099 7/20 0.46
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 1/20 0.43
HIF1A Q16665 1/20 0.43
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
PLA2G2A P14555 1/20 0.41
CASP2 P42575 1/20 0.40
FAAH O00519 1/20 0.39
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
S1PR2 O95136 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 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
SCHEMBL7612872 1.00 PAOX (0.63) PAOXEPHX1KDM4EMAPK1HIF1A
SCHEMBL3279918 0.98 PAOX (0.66) PAOXEPHX1KDM4EMAPK1HIF1A
SCHEMBL3278941 0.94 PAOX (0.60) PAOXEPHX1KDM4EMAPK1HIF1A
SCHEMBL3280463 0.93 EPHX1 (0.53) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL2832070 0.91 EPHX1 (0.53) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL2828036 0.91 EPHX1 (0.53) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL3280294 0.91 EPHX1 (0.52) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL1846396 0.91 EPHX1 (0.52) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL10423555 0.91 PAOX (0.55) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A
SCHEMBL3279963 0.91 PAOX (0.55) PAOXEPHX1ZDHHC20ZDHHC2PLA2G2A

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
US-6423487-B2 ACYCLIC OR HETEROCYCLIC AMINOALKYL (METH)ACRYLAMIDE POLYMERS OR POLYMERS OF (METH)ACRYLATED ALKYLENE OXIDE ADDUCTS OF PIPERAZINES OR MORPHOLINE AS VISCOSITY ENHANCERS FUJI PHOTO FILM CO., LTD. (JP) 2002-07-23 US disclosed
US-20020015927-A1 Thermally processed image recording material FUJIFILM CORPORATION (JP) 2002-02-07 US disclosed