SCHEMBL8323833

SCHEMBL8323833

O=C(O)c1ccc(/C=C/c2ccccc2OCc2ccccc2)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.57
PTGER4 P35408 1/20 0.57
PTGER3 P43115 1/20 0.57
PTGER2 P43116 1/20 0.57
CCNB2 O95067 1/20 0.52
CDK1 P06493 1/20 0.52
CDK4 P11802 1/20 0.52
CCNB1 P14635 1/20 0.52
CCND1 P24385 1/20 0.52
CCNB3 Q8WWL7 1/20 0.52
PTPN1 P18031 3/20 0.51
KDM4E B2RXH2 2/20 0.50
MCL1 Q07820 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
APP P05067 1/20 0.47
AKR1B10 O60218 1/20 0.46
TTR P02766 1/20 0.46
AKR1B1 P15121 1/20 0.46

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
SCHEMBL8323838 1.00 PTGER1 (0.57) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8322341 0.89 PTGER4 (0.53) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8319700 0.89 PTGER4 (0.53) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8319694 0.89 PTGER4 (0.53) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8321350 0.86 PTGER4 (0.55) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8325293 0.86 PTGER4 (0.55) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8321345 0.86 PTGER4 (0.55) PTGER1PTGER4PTGER3PTGER2CCNB2
SCHEMBL8323393 0.85 GCK (0.62) PTGER1PTGER4PTGER3PTGER2PTPN1
SCHEMBL8323389 0.85 GCK (0.62) PTGER1PTGER4PTGER3PTGER2PTPN1
SCHEMBL7774919 0.81 PTGER1 (0.64) PTGER1PTGER4PTGER3PTGER2CCNB2

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-0733033-B1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LTD (GB) 1999-12-22 EP disclosed
WO-1996011902-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-04-25 WO disclosed