SCHEMBL5732630

SCHEMBL5732630

CCOP(=O)(O)CC(=O)c1cccc(C=C2CCOCC2)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ FAAH O00519 3/20 0.33
▸ NR1I2 O75469 1/20 0.32
▸ SRD5A1 P18405 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ OGA O60502 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
SCHEMBL5732625 0.83 LMNA (0.38) ALDH1A1L3MBTL1FAAHSRD5A1LMNA
SCHEMBL5733122 0.78 RXFP1 (0.39) ALDH1A1NR1I2SMN1; SMN2LMNAPOLB
SCHEMBL5732978 0.74 SMN1; SMN2 (0.37) ALDH1A1L3MBTL1SMN1; SMN2NPC1TP53
SCHEMBL5733074 0.73 L3MBTL1 (0.47) ALDH1A1L3MBTL1HPGDSMN1; SMN2LMNA
SCHEMBL5732716 0.73 KDM4E (0.45) ALDH1A1FAAHLMNAPOLBNPC1
SCHEMBL23684304 0.73 UNG (0.53) HPGDSRD5A1SMN1; SMN2LMNARAB9A
SCHEMBL5734228 0.72 CYP4F2 (0.42) SMN1; SMN2LMNAPOLBNPC1TP53
SCHEMBL5732673 0.71 CES2 (0.51) ALDH1A1HPGDSMN1; SMN2POLBNPC1
SCHEMBL5734479 0.71 L3MBTL1 (0.50) ALDH1A1L3MBTL1HPGDLMNAPOLB
SCHEMBL5733422 0.71 RAB9A (0.51) ALDH1A1L3MBTL1HPGDSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1409455-B1 PROSTAGLANDIN ANALOGUES-AS EP4 RECEPTOR AGONISTS HOFFMANN LA ROCHE (CH) 2006-01-04 — — EP disclosed
US-6900336-B2 8-aza-11-deoxy prostaglandin analogues SYNTEX (U.S.A.) LLC (US) 2005-05-31 — — US disclosed
EP-1409455-A1 PROSTAGLANDIN ANALOGUES-AS EP4 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-21 — — EP disclosed
US-20030120079-A1 Such as 7-((R)-2-((E)-3-(3-Benzyl-phenyl)-3-hydroxy-propenyl)-5-oxo-pyrrolidin-1-yl)-heptanoic acid; side effects reduction SYNTEX (U.S.A.) LLC 2003-06-26 — — US disclosed
WO-2003008377-A1 PROSTAGLANDIN ANALOGUES_AS EP4 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-01-30 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030120079-A1 Such as 7-((R)-2-((E)-3-(3-Benzyl-phenyl)-3-hydroxy-propenyl)-5-oxo-pyrrolidin-1-yl)-heptanoic acid; side effects reduction PTGER4, FFAR4, PTGER1 ALDH1A1 569/4885L3MBTL1 2782/4885HPGD 692/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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