SCHEMBL7492500

SCHEMBL7492500

COC(=O)COc1cccc2c1CCCC2O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
PTGIR P43119 6/20 0.46
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
TAS1R2 Q8TE23 2/20 0.45
PTGDR2 Q9Y5Y4 2/20 0.44
PTGDR Q13258 1/20 0.44
LMNA P02545 1/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
POLL Q9UGP5 1/20 0.42
TBXAS1 P24557 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
SCHEMBL1835786 0.86 KMT2A (0.50) KMT2APTGIRTAS1R3TAS1R1TAS1R2
SCHEMBL1835788 0.86 KMT2A (0.50) KMT2APTGIRTAS1R3TAS1R1TAS1R2
SCHEMBL7482096 0.86 PTGIR (0.45) KMT2APTGIRTAS1R3TAS1R1TAS1R2
SCHEMBL8411209 0.84 PTGIR (0.56) PTGIRTBXAS1
SCHEMBL8413684 0.82 PTGIR (0.57) PTGIRTBXAS1
SCHEMBL8414245 0.82 PTGIR (0.57) PTGIR
SCHEMBL8577075 0.81 PTGIR (0.64) PTGIRTBXAS1
SCHEMBL8414336 0.80 PTGIR (0.49) PTGIRTBXAS1
SCHEMBL7483364 0.80 USP2 (0.45) KMT2ALMNAPOLL
SCHEMBL10463185 0.79 TAS1R3 (0.56) KMT2APTGIRTAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842161-B1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2002-09-18 EP disclosed
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