SCHEMBL11728896

SCHEMBL11728896

CS(=O)(=O)N(C/C=C\CCCC(=O)O)C/C=C/C(O)COc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGFR P43088 11/20 0.42
▸ TBXA2R P21731 6/20 0.42
▸ PTGER3 P43115 5/20 0.42
▸ PTGER1 P34995 2/20 0.42
▸ THRB P10828 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LTA4H P09960 2/20 0.38
▸ PTGER2 P43116 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
SCHEMBL11728900 1.00 PTGFR (0.42) PTGFRTBXA2RPTGER3PTGER1THRB
SCHEMBL11732048 0.89 LTA4H (0.41) PTGFRTBXA2RPTGER3PTGER1LTA4H
SCHEMBL11732036 0.89 LTA4H (0.41) PTGFRTBXA2RPTGER3PTGER1LTA4H
SCHEMBL11728906 0.86 LTA4H (0.39) PTGFRTBXA2RPTGER3PTGER1LTA4H
SCHEMBL11728916 0.86 LTA4H (0.39) PTGFRTBXA2RPTGER3PTGER1LTA4H
SCHEMBL11847837 0.85 LTA4H (0.36) PTGFRTBXA2RPTGER3PTGER1THRB
SCHEMBL11847831 0.85 LTA4H (0.36) PTGFRTBXA2RPTGER3PTGER1THRB
SCHEMBL11656395 0.78 PTGFR (0.44) PTGFRTBXA2RPTGER3PTGER1THRB
SCHEMBL11729663 0.76 PTGFR (0.38) PTGFRTBXA2RPTGER3PTGER1THRB
SCHEMBL11729672 0.76 PTGFR (0.38) PTGFRTBXA2RPTGER3PTGER1THRB

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
US-4055596-A PHARMACEUTICALS MERCK & CO., INC. (US) 1977-10-25 — — US disclosed
US-3991106-A FOR ESTRUS SYNCHRONIZATION AND TREATMENT OF INFERTILITY MERCK & CO., INC. (US) 1976-11-09 — — US disclosed
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