SCHEMBL1758960

SCHEMBL1758960

O=CCc1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.44
PTGER3 P43115 8/20 0.44
PTGER1 P34995 8/20 0.44
PTGER2 P43116 7/20 0.44
GSTP1 P09211 2/20 0.41
BCHE P06276 4/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37

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
SCHEMBL1759133 0.85 PTGER1 (0.45) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL8917358 0.81 PTGER4 (0.45) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL8406774 0.81 PDCD1 (0.50) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL16809426 0.81 HTR1A (0.48) PTGER4PTGER3PTGER1PTGER2BCHE
SCHEMBL19905553 0.81 PTGER4 (0.56) PTGER4PTGER3PTGER1PTGER2BCHE
SCHEMBL26185970 0.80 PTGER4 (0.44) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL1758900 0.79 CYP4F2 (0.50) PTGER4PTGER3PTGER1PTGER2BCHE
SCHEMBL1638769 0.79 PTGER1 (0.46) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL5810886 0.78 NPC1 (0.41) BCHEMAOAMAOBKDM4EL3MBTL1
SCHEMBL1759115 0.77 FEN1 (0.44) PTGER4PTGER3PTGER1PTGER2BCHE

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
EP-2493932-A2 CATALYST COMPOUNDS AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2012-09-05 EP disclosed
WO-2011056423-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed