SCHEMBL7616622

SCHEMBL7616622

CCCCCCC(F)(F)C(O)CC[C@@H]1[C@@H](CCCCCCC=CC(=O)OC(C)C)[C@@H](O)C[C@H]1OC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADRA2C P18825 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ MC3R P41968 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ SCN5A Q14524 1/20 0.34
▸ TBXA2R P21731 1/20 0.32
▸ PTGFR P43088 1/20 0.32
▸ PTGER2 P43116 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7616619 0.83 PGR (0.34) PGRADORA3ADRA2CSLC6A2HTR2B
SCHEMBL3015123 0.81 PTGFR (0.47) TBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL3015120 0.81 PTGFR (0.47) TBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL11912317 0.81 PTGFR (0.47) TBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL14394168 0.79 PTGFR (0.36) TBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL15106327 0.78 MEN1 (0.45) PDE4DTBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL15106324 0.78 MEN1 (0.45) PDE4DTBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL15106483 0.78 MEN1 (0.45) PDE4DTBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL15106326 0.78 MEN1 (0.45) PDE4DTBXA2RPTGFRPTGER2ALDH1A1
SCHEMBL15106482 0.78 MEN1 (0.45) PDE4DTBXA2RPTGFRPTGER2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6452039-B1 PROSTANOIC ACID DERIVATIVE WHEREIN THE ALPHA CHAIN HAS EIGHT OR MORE SKELETAL CARBON ATOMS; EXTREMELY STRONG ACTION; HYPERTENSION, ASTHMA, DIABETES, ARTERIAL SCLEROSIS, RENAL FAILURE, CARDIAC INFARCTION, ANGINA PECTORIS SUCAMPO AG (CH) 2002-09-17 — — US disclosed
EP-0857718-B1 ENDOTHELIN ANTAGONIST SUCAMPO AG (CH) 2002-08-14 — — EP disclosed
US-6242485-B1 ADMINISTERING PROSTANOIC ACID DERIVATIVE TO TREAT VISION, KIDNEY, CARDIOVASCULAR AND BRAIN DISORDERS; HYPOTENSIVE AND ANTIASTHMATIC AGENTS R-TECH UENO (JP) 2001-06-05 — — US disclosed
EP-0857718-A1 ENDOTHELIN ANTAGONIST R-Tech Ueno, Ltd. (JP) 1998-08-12 — — EP disclosed
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