SCHEMBL9546273

SCHEMBL9546273

COC(=O)CCCC#C/C=C1\C(=O)C(S(=O)(=O)CCCCCC(=O)OC)=CC1/C=C/C(O)C1CCCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 1/20 0.32
▸ PTGER3 P43115 1/20 0.31

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
SCHEMBL9546280 1.00 PTGER4 (0.32) PTGER4PTGER3
SCHEMBL9546397 0.90 LTB4R (0.34) PTGER4PTGER3
SCHEMBL9546390 0.90 LTB4R (0.34) PTGER4PTGER3
SCHEMBL9546283 0.86 ITGB1 (0.32) PTGER4PTGER3
SCHEMBL9546291 0.86 ITGB1 (0.32) PTGER4PTGER3
SCHEMBL9546140 0.84 PTGER4 (0.32) PTGER4PTGER3
SCHEMBL9546142 0.84 PTGER4 (0.32) PTGER4PTGER3
SCHEMBL9546171 0.83 PTGER4 (0.32) PTGER4PTGER3
SCHEMBL9546169 0.83 PTGER4 (0.32) PTGER4PTGER3
SCHEMBL10622120 0.80 PTGER3 (0.35) PTGER4PTGER3

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-0338796-B1 2-SUBSTITUTED-2-CYCLOPENTENONES TEIJIN LIMITED (JP) 1993-03-10 — — EP disclosed
US-5116869-A Antitumor Agents, Bone Formation Accelerator TEIJIN LIMITED (JP) 1992-05-26 — — US disclosed
EP-0338796-A2 2-Substituted-2-cyclopentenones TEIJIN LIMITED (JP) 1989-10-25 — — EP disclosed
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