SCHEMBL5388557

SCHEMBL5388557

COC(=O)/C(C)=C/C1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
GRIK1 P39086 2/20 0.34
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
EPHX2 P34913 1/20 0.33
GRIK2 Q13002 1/20 0.32
EPHX1 P07099 4/20 0.32
OPRK1 P41145 1/20 0.32
GFER P55789 1/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 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
SCHEMBL25410634 1.00 NPSR1 (0.35) NPSR1GRIK1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL17159432 1.00 NPSR1 (0.35) NPSR1GRIK1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL28178766 1.00 NPSR1 (0.35) NPSR1GRIK1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL639052 1.00 NPSR1 (0.35) NPSR1GRIK1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL16445725 0.98 ALDH1A1 (0.34) NPSR1GRIK1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL27830025 0.84 GRIK1 (0.34) GRIK1GRIK2EPHX1
SCHEMBL28962046 0.82 EPHX1 (0.42) GRIK1SMN1; SMN2EPHX1
SCHEMBL809146 0.82 EPHX1 (0.42) GRIK1SMN1; SMN2EPHX1
SCHEMBL6145484 0.82 EPHX1 (0.42) GRIK1SMN1; SMN2EPHX1
SCHEMBL27823244 0.82 EPHX1 (0.42) GRIK1SMN1; SMN2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7295376-B2 Pseudo cross-link type resin composition, molding material, sheet or film, and optical element obtained therefrom HITACHI CHEMICAL COMPANY, LTD. (JP) 2007-11-13 US disclosed
US-20050038194-A1 Pseudo cross-link type resin composition, molding material, sheet or film, and optical element obtained therefrom YAMANAKA TETSURO (JP) 2005-02-17 US disclosed
US-6767967-B2 FLEXIBILITY; HYDROGEN BONDED BLEND HITACHI CHEMICAL CO., LTD. (JP) 2004-07-27 US disclosed
US-20030232923-A1 Pseudo cross-link type resin composition, molding material, sheet or film, and optical element obtained therefrom HITACHI CHEMICAL CO., LTD. (JP) 2003-12-18 US disclosed