SCHEMBL7922115

SCHEMBL7922115

O=C(O)C=Cc1ccccc1Cc1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 10/20 1.00
PTGER2 P43116 8/20 1.00
PTGER4 P35408 7/20 1.00
PTGDR Q13258 5/20 1.00
TBXA2R P21731 4/20 1.00
PTGFR P43088 3/20 1.00
PTGER1 P34995 5/20 0.69
PTGIR P43119 2/20 0.69
DRD3 P35462 1/20 0.51
FTO Q9C0B1 1/20 0.48
CAPN1 P07384 1/20 0.46
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
SOX18 P35713 1/20 0.46
EGFR P00533 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
SCHEMBL7922112 1.00 PTGER3 (1.00) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7929714 0.86 PTGER3 (1.00) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7929719 0.86 PTGER3 (1.00) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7819865 0.85 PTGER3 (0.74) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7819867 0.85 PTGER3 (0.74) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7817228 0.83 PTGER3 (0.71) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL7817233 0.83 PTGER3 (0.71) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL157606 0.83 PTGER3 (0.73) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL2981086 0.82 PTGER3 (0.70) PTGER3PTGER2PTGER4PTGDRTBXA2R
SCHEMBL2981091 0.82 PTGER3 (0.70) PTGER3PTGER2PTGER4PTGDRTBXA2R

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