SCHEMBL8806002

SCHEMBL8806002

OCCCc1cccc(OCCOC2CCCCO2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4C Q9H3R0 1/20 0.47
DHFR P00374 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
ACACB O00763 2/20 0.38
ACACA Q13085 1/20 0.38
KCNH2 Q12809 3/20 0.37
POLB P06746 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL10679055 0.93 MEN1 (0.51) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL10720275 0.92 KDM4C (0.51) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL10677339 0.91 MEN1 (0.51) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL3744988 0.88 MEN1 (0.49) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL8384076 0.86 KDM4C (0.49) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL3740904 0.85 MEN1 (0.46) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL14845812 0.83 KDM4E (0.49) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL10680301 0.82 KDM4C (0.50) MEN1KMT2AKDM4CDHFRNPC1
SCHEMBL10684106 0.81 MEN1 (0.49) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL10682289 0.81 MEN1 (0.49) MEN1KMT2AKDM4CNPC1RAB9A

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
EP-0558062-B1 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO (JP) 1997-05-07 EP disclosed
US-5536736-A CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 1996-07-16 US disclosed
US-5378716-A Prostaglandin agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-01-03 US disclosed
EP-0558062-A2 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-01 EP disclosed