SCHEMBL7052348

SCHEMBL7052348

CC(C)(C)[Si](Oc1cccc2c1CC[C@](O)(COC(=O)N(c1ccc(F)cc1)c1ccc(F)cc1)C2)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 15/20 0.61
PTGDR Q13258 5/20 0.61
PTGER3 P43115 2/20 0.61
PTGER1 P34995 1/20 0.61
PTGER4 P35408 1/20 0.30
PTGER2 P43116 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
AGTR2 P50052 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
SCHEMBL7778395 0.95 PTGIR (0.67) PTGIRPTGDRPTGER3PTGER1
SCHEMBL7776620 0.95 PTGIR (0.67) PTGIRPTGDRPTGER3PTGER1
SCHEMBL8481589 0.87 PTGIR (0.56) PTGIRPTGDRPTGER3PTGER1
SCHEMBL7050827 0.81 PTGIR (0.91) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7050802 0.81 PTGIR (0.87) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7051546 0.80 PTGIR (0.64) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7717816 0.80 PTGIR (0.49) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7047631 0.79 PTGIR (0.74) PTGIRPTGDRPTGER3PTGER1
SCHEMBL7778642 0.78 PTGER1 (0.40) PTGIRPTGDRPTGER3PTGER1
SCHEMBL7055364 0.78 PTGER1 (0.40) PTGIRPTGDRPTGER3PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042277-B1 NAPHTHALENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-04-23 EP disclosed
US-6303649-B1 FOR THERAPY AND PROPHYLAXIS OF ARTERIAL OBSTRUCTION, CEREBROVASCULAR DISEASE, HEPATIC CIRRHOSIS, ARTERIOSCLEROSIS, ISCHEMIC HEART DISEASE, RESTENOSIS, ISCHEMIC COMPLICATIONS AFTER CORONARY ANGIOPLASTY, HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-16 US disclosed