SCHEMBL7929784

SCHEMBL7929784

O=C(O)C=Cc1cc(Cl)ccc1Cc1ccc2cc(Cl)ccc2c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 6/20 0.64
PTGDR Q13258 5/20 0.64
PTGER2 P43116 5/20 0.64
TBXA2R P21731 4/20 0.64
PTGFR P43088 3/20 0.64
PTGER4 P35408 3/20 0.64
PTGIR P43119 2/20 0.55
PTGER1 P34995 2/20 0.55
EGFR P00533 1/20 0.50
ITGB2 P05107 2/20 0.40
ICAM1 P05362 2/20 0.40
ITGAL P20701 2/20 0.40
LMNA P02545 1/20 0.40
PLA2G1B P04054 1/20 0.40
MAPT P10636 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
CTRC Q99895 1/20 0.37
FTO Q9C0B1 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
SCHEMBL7929782 1.00 PTGER3 (0.64) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7934282 0.99 PTGER3 (0.62) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7934277 0.99 PTGER3 (0.62) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7934284 0.99 PTGER3 (0.62) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7819867 0.94 PTGER3 (0.74) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7819865 0.94 PTGER3 (0.74) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7928606 0.89 PTGER3 (0.60) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7928601 0.89 PTGER3 (0.60) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7814525 0.87 PTGER3 (0.59) PTGER3PTGDRPTGER2TBXA2RPTGFR
SCHEMBL7814518 0.87 PTGER3 (0.59) PTGER3PTGDRPTGER2TBXA2RPTGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242493-B1 PROSTAGLANDIN INHIBITORS; ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS MERCK FROSST CANADA & CO. (CA) 2001-06-05 US disclosed