SCHEMBL8324836

SCHEMBL8324836

O=C(O)c1ccc(CCCCCc2ccccc2OCc2ccccc2)cc1

nearest known ligand 0.92

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 1/20 0.92
▸ PTGER4 P35408 1/20 0.92
▸ PTGER3 P43115 1/20 0.92
▸ PTGER2 P43116 1/20 0.92
▸ HTR1A P08908 1/20 0.59
▸ DRD2 P14416 1/20 0.59
▸ MGLL Q99685 1/20 0.59
▸ RXRA P19793 7/20 0.58
▸ RXRB P28702 6/20 0.58
▸ RXRG P48443 5/20 0.58
▸ HPGD P15428 1/20 0.58
▸ FOLH1 Q04609 1/20 0.56
▸ NR4A1 P22736 1/20 0.54
▸ NR4A2 P43354 1/20 0.54
▸ NR4A3 Q92570 1/20 0.54
▸ ABCB1 P08183 2/20 0.52
▸ PLA2G4B P0C869 1/20 0.52
▸ SRD5A2 P31213 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
SCHEMBL8321768 0.99 PTGER1 (0.95) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8319420 0.96 PTGER1 (1.00) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL15726355 0.90 PTGER1 (0.84) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8406722 0.90 PTGER1 (0.84) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8321843 0.86 PTGER1 (0.81) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8327569 0.86 PTGER1 (0.73) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8323719 0.85 PTGER1 (0.81) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8324213 0.85 PTGER1 (0.80) PTGER1PTGER4PTGER3PTGER2RXRA
SCHEMBL8319795 0.84 PTGER1 (0.78) PTGER1PTGER4PTGER3PTGER2RXRA
SCHEMBL9056821 0.84 PTGER1 (0.78) PTGER1PTGER4PTGER3PTGER2HTR1A

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
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 — — EP disclosed
WO-1996011902-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-04-25 — — WO disclosed
Send feedback