SCHEMBL18965693

SCHEMBL18965693

CCCCC(F)(F)C(=O)/C=C/[C@H]1CCC(OC)C1C/C=C\CCCC(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
PDE4D Q08499 7/20 0.40
PTGER3 P43115 3/20 0.37
PTGER4 P35408 2/20 0.37
PTGER2 P43116 2/20 0.37
EPHX2 P34913 1/20 0.34
ALOX5 P09917 2/20 0.34
OXER1 Q8TDS5 1/20 0.34
TBXA2R P21731 3/20 0.34
PTGER1 P34995 1/20 0.34
PTGFR P43088 1/20 0.34
PTGDR Q13258 1/20 0.34
PGR P06401 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADRA2C P18825 1/20 0.33

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
SCHEMBL862429 0.77 POLB (0.37) ALDH1A1PDE4DPTGER2EPHX2PGR
SCHEMBL9976701 0.77 POLB (0.37) ALDH1A1PDE4DPTGER2EPHX2PGR
SCHEMBL862237 0.77 POLB (0.37) ALDH1A1PDE4DPTGER2EPHX2PGR
SCHEMBL12087973 0.77 POLB (0.39) ALDH1A1PTGER3PTGER4PTGER2EPHX2
SCHEMBL18965531 0.76 POLB (0.38) ALDH1A1PTGER3PTGER4PTGER2EPHX2
SCHEMBL11599490 0.74 KDM4E (0.46) KDM4EALDH1A1HKDC1TDP1SAE1
SCHEMBL11599487 0.74 KDM4E (0.46) KDM4EALDH1A1HKDC1TDP1SAE1
SCHEMBL11599493 0.74 KDM4E (0.46) KDM4EALDH1A1HKDC1TDP1SAE1
SCHEMBL13119839 0.73 PDE4D (0.51) KDM4EALDH1A1HKDC1TDP1SAE1
SCHEMBL3008851 0.73 PDE4D (0.51) KDM4EALDH1A1HKDC1TDP1SAE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981867-B1 METHOD FOR PREPARING PROSTAGLANDIN DERIVATIVE R-TECH UENO LTD (JP) 2017-06-14 EP disclosed