SCHEMBL8324745

SCHEMBL8324745

O=C(O)c1ccc(C=CCc2cc(Cl)ccc2OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 13/20 0.56
MRGPRX4 Q96LA9 4/20 0.56
PTGER4 P35408 2/20 0.50
PTGER3 P43115 2/20 0.50
PTGER2 P43116 2/20 0.50
CYP2C9 P11712 1/20 0.49
HPGD P15428 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49

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
SCHEMBL8325688 1.00 PTGER1 (0.56) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8324739 1.00 PTGER1 (0.56) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8327463 0.91 PTGER1 (0.54) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8327466 0.91 PTGER1 (0.54) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8321952 0.84 GCK (0.57) PTGER1PTGER4PTGER3PTGER2RXRA
SCHEMBL8321955 0.84 GCK (0.57) PTGER1PTGER4PTGER3PTGER2RXRA
SCHEMBL15726358 0.83 MRGPRX4 (0.60) PTGER1MRGPRX4CYP2C9HPGDRXRA
SCHEMBL8677610 0.82 PTGER1 (0.58) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8409624 0.80 MRGPRX4 (0.66) PTGER1MRGPRX4PTGER4PTGER3PTGER2
SCHEMBL8321739 0.80 MRGPRX4 (0.66) PTGER1MRGPRX4PTGER4PTGER3PTGER2

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