SCHEMBL7778581

SCHEMBL7778581

CCOC(=O)COc1cccc2c1CCC(O)(COC(=O)N(c1ccccc1)c1ccccc1)C2O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.81
PTGDR Q13258 2/20 0.53
PTGER1 P34995 1/20 0.53
PTGER3 P43115 1/20 0.53
ABCB1 P08183 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
CASP3 P42574 1/20 0.34
CASP7 P55210 1/20 0.34
CASP9 P55211 1/20 0.34
LMNA P02545 2/20 0.34
PTPN1 P18031 1/20 0.34

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
SCHEMBL8486136 0.92 PTGIR (0.69) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7778649 0.90 PTGIR (0.66) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7779787 0.90 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7718277 0.84 PTGIR (0.89) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7777435 0.84 PTGIR (0.57) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL8486134 0.83 PTGIR (0.57) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7778654 0.83 PTGIR (0.56) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7776656 0.81 PTGIR (0.80) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7778514 0.81 PTGIR (0.80) PTGIRPTGDRPTGER1PTGER3ABCB1
SCHEMBL7778523 0.81 PTGIR (0.80) PTGIRPTGDRPTGER1PTGER3ABCB1

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-0749424-B1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-12 EP disclosed
US-5863918-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-01-26 US disclosed
US-5763489-A ANTICOAGULANTS AND HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
EP-0749424-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 EP disclosed
WO-1995024393-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 WO disclosed