SCHEMBL10703299

SCHEMBL10703299

CCCC[C@H](C)C[C@@H](/C=C/[C@H]1[C@H](OC2CCCCO2)CC(=O)[C@@H]1CC(=O)CC/C=C/C(=O)O)OC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 3/20 0.34
▸ PTGER4 P35408 2/20 0.32
▸ PTGER2 P43116 2/20 0.32
▸ NR1I2 O75469 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ TBXA2R P21731 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ PTGER1 P34995 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ PTGFR P43088 1/20 0.32
▸ PTGER3 P43115 1/20 0.32
▸ PDE4D Q08499 1/20 0.32

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
SCHEMBL10704350 0.90 PTGIR (0.41) PTGIRPTGER4PTGER2NR1I2ESR1
SCHEMBL10353583 0.90 PTGIR (0.41) PTGIRPTGER4PTGER2NR1I2ESR1
SCHEMBL11387487 0.87 PTGIR (0.34) PTGIRPTGER4PTGER2PGRHPGD
SCHEMBL10702023 0.85 PDE4D (0.35) PTGIRPTGER4HPGDTSHRTBXA2R
SCHEMBL10701433 0.85 PDE4D (0.35) PTGIRPTGER4HPGDTSHRTBXA2R
SCHEMBL11389584 0.85 PTGER3 (0.34) PTGIRPTGER4PTGER2NR1I2ESR1
SCHEMBL11380894 0.85 PTGIR (0.34) PTGIRPTGER4PTGER2NR1I2ESR1
SCHEMBL10353179 0.85 PTGIR (0.33) PTGIR
SCHEMBL10353925 0.84 PTGIR (0.32) PTGIR
SCHEMBL11393376 0.84 ALDH1A1 (0.32) PTGIRPTGER4PTGER2PGRPTGER3

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-0156611-B1 INTERMEDIATES FOR THE PREPARATION OF PROSTAGLANDIN ANALOGUES ONO PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 — — EP disclosed
US-4622410-A CHEMICAL INTERMEDIATES FOR 6-KETO-PROSTAGLANDINS ONO PHARMACEUTICAL CO. LTD. (JP) 1986-11-11 — — US disclosed
EP-0156611-A2 Intermediates for the preparation of prostaglandin analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1985-10-02 — — EP disclosed
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