SCHEMBL7494308

SCHEMBL7494308

COC(=O)COc1cccc2c1CCC(NCc1nc(-c3ccccc3)c(-c3ccccc3)o1)C2

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.48
NR4A2 P43354 2/20 0.42
PTGIR P43119 10/20 0.42
DRD3 P35462 3/20 0.42
DRD4 P21917 2/20 0.42
PTGDR Q13258 6/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
ACHE P22303 2/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41

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
SCHEMBL7499160 0.92 PTGIR (0.49) DRD2NR4A2PTGIRPTGDR
SCHEMBL7485442 0.81 DRD2 (0.50) DRD2NR4A2DRD3DRD4CA1
SCHEMBL7492298 0.80 DRD2 (0.46) DRD2NR4A2DRD3DRD4CA1
SCHEMBL7494311 0.80 DRD2 (0.43) DRD2PTGIRDRD3DRD4PTGDR
SCHEMBL7494415 0.78 PTGIR (0.45) NR4A2PTGIR
SCHEMBL7485190 0.77 NR4A2 (0.50) DRD2NR4A2PTGIRDRD3PTGDR
SCHEMBL7485549 0.75 PTGIR (0.49) DRD2NR4A2PTGIRDRD3
SCHEMBL7483732 0.75 PTGIR (0.51) DRD2NR4A2PTGIRDRD3
SCHEMBL7494535 0.75 PTGIR (0.49) NR4A2PTGIRCA1CA2ACHE
SCHEMBL7488605 0.75 PTGIR (0.49) NR4A2PTGIRCA1CA2ACHE

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-1213285-A2 4,5-dipheny-oxazole derivatives and their use as platelet aggregation inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-06-12 EP disclosed
US-6300344-B1 FOR THERAPEUTIC AND/OR PROPHYLACTIC TREATMENT OF ARTERIAL OBSTRUCTION, CEREBROVASCULAR DISEASE, HEPATIC CIRRHOSIS, ARTERIOSCLEROSIS, ISCHEMIC HEART DISEASE, RESTENOSIS AFTER PERCUTANEOUS TRANSLUMINAL CORONARY ANGIOPLASTY, HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US disclosed
US-5972965-A USEFUL FOR INHIBITION OF PLATELET AGGREGATION, VASODILATION, ANTIHYPERTENSIVE ACTIVITY AND PROSTAGLANDIN AGONIST FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0842161-A1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-20 EP disclosed
WO-1997003973-A1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-06 WO disclosed