SCHEMBL3367848

SCHEMBL3367848

O=C(O)CCCC=CC[C@H]1C(=O)C[C@@H](O)[C@@H]1C=CC(O)CCc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.78
PTGFR P43088 7/20 0.72
PTGER3 P43115 6/20 0.72
PTGER4 P35408 5/20 0.71
PTGER1 P34995 4/20 0.71
PTGER2 P43116 2/20 0.71
PTGIR P43119 2/20 0.71
TBXA2R P21731 2/20 0.71
NR1I2 O75469 1/20 0.71
ESR1 P03372 1/20 0.71
PGR P06401 1/20 0.71
HPGD P15428 1/20 0.71
TSHR P16473 1/20 0.71
MAPK1 P28482 1/20 0.71
OPRK1 P41145 1/20 0.71
PDE4D Q08499 1/20 0.71
ABCB11 O95342 1/20 0.56
AKR1C3 P42330 1/20 0.56
MEN1 O00255 1/20 0.56
THRB P10828 1/20 0.56

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
SCHEMBL13260944 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL13399820 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL3367843 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL13399725 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL3367851 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL23352763 1.00 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL125099 0.90 PTGFR (0.67) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL125098 0.90 PTGFR (0.67) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL125097 0.90 PTGFR (0.67) MGLLPTGFRPTGER3PTGER4PTGER1
SCHEMBL12928670 0.90 MGLL (0.78) MGLLPTGFRPTGER3PTGER4PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105771-A1 AMINO ACID SALTS OF PROSTAGLANDINS NOVAER HOLDINGS, INC. 2010-04-29 US claimed
EP-2349242-B1 AMINO ACID SALTS OF PROSTAGLANDINS NOVAER HOLDINGS INC (US) 2018-12-05 EP disclosed
US-8722739-B2 Amino acid salts of prostaglandins NOVAER HOLDINGS, INC. (US) 2014-05-13 US disclosed
US-8623918-B2 Amino acid salts of prostaglandins NOVAER HOLDINGS, INC. (US) 2014-01-07 US disclosed
US-8470882-B2 2013-06-25 US disclosed
US-20100105771-A1 AMINO ACID SALTS OF PROSTAGLANDINS NOVAER HOLDINGS, INC. 2010-04-29 US disclosed
US-20100105775-A1 AMINO ACID SALTS OF PROSTAGLANDINS NOVAER HOLDINGS, INC. 2010-04-29 US 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 (2 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-20100105771-A1 AMINO ACID SALTS OF PROSTAGLANDINS PTGIS, PTGES, PTGIR MGLL 1291/4885PTGFR 7/4885PTGER3 16/4885
US-20100105775-A1 AMINO ACID SALTS OF PROSTAGLANDINS PTGIS, PTGES, PTGIR MGLL 1291/4885PTGFR 7/4885PTGER3 16/4885

“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.