SCHEMBL8324233

SCHEMBL8324233

COC(=O)c1ccc(CCCc2ccccc2OCc2ccccc2)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.61
PTGER3 P43115 3/20 0.61
PTGER2 P43116 3/20 0.61
PTGER1 P34995 2/20 0.61
SMPD1 P17405 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
RXRA P19793 1/20 0.51
MTNR1B P49286 2/20 0.51
ABCB1 P08183 4/20 0.50
MTNR1A P48039 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTR1A P08908 1/20 0.50
DRD2 P14416 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL8328278 0.95 SMPD1 (0.56) PTGER4PTGER3PTGER2PTGER1SMPD1
SCHEMBL8327593 0.87 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1HPGD
SCHEMBL8322717 0.87 PTGER1 (0.77) PTGER4PTGER3PTGER2PTGER1HPGD
SCHEMBL8322728 0.85 LMNA (0.61) PTGER4PTGER3PTGER2PTGER1SMPD1
SCHEMBL9064386 0.85 PTGER1 (0.73) PTGER4PTGER3PTGER2PTGER1HPGD
SCHEMBL8327569 0.84 PTGER1 (0.73) PTGER4PTGER3PTGER2PTGER1HPGD
SCHEMBL8323831 0.84 PTGER1 (0.52) PTGER4PTGER3PTGER2PTGER1SMPD1
SCHEMBL8324369 0.84 PTGER1 (0.52) PTGER4PTGER3PTGER2PTGER1SMPD1
SCHEMBL8322616 0.84 ABCB1 (0.52) PTGER4PTGER3PTGER2PTGER1SMPD1
SCHEMBL2188210 0.82 SMPD1 (0.76) SMPD1HDAC1HDAC8HDAC6HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733033-B1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LTD (GB) 1999-12-22 EP disclosed
US-5811459-A PAIN RELIEVERS ZENECA LIMITED (GB) 1998-09-22 US disclosed
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 EP disclosed