SCHEMBL7779678

SCHEMBL7779678

CC(C)(C)[Si](Oc1cccc2c1CCC(=O)C2CCOC(=O)N(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 10/20 0.39
PTGDR Q13258 5/20 0.36
PTGER1 P34995 1/20 0.36
PTGER3 P43115 1/20 0.36
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ACHE P22303 3/20 0.31
GRM5 P41594 1/20 0.30
GRM1 Q13255 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
SCHEMBL7779788 0.84 PTGIR (0.45) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL7778597 0.84 PTGIR (0.40) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL7778522 0.84 PTGIR (0.40) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL7778520 0.84 PTGIR (0.40) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL8486810 0.83 PTGIR (0.40) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL7772412 0.78 PTGIR (0.42) PTGIRPTGDRPTGER1PTGER3ACHE
SCHEMBL7772415 0.78 PTGIR (0.42) PTGIRPTGDRPTGER1PTGER3ACHE
SCHEMBL7776674 0.78 PTGIR (0.42) PTGIRPTGDRPTGER1PTGER3ACHE
SCHEMBL8485232 0.78 PTGIR (0.38) PTGIRPTGDRPTGER1PTGER3CHRM4
SCHEMBL7718887 0.77 PTGIR (0.40) PTGIRPTGDRPTGER1PTGER3

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