SCHEMBL7490663

SCHEMBL7490663

O=C(c1ccccc1)C(OC(=O)C1CCCCN1C(=O)c1cccc(OCc2ccccc2)c1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 2/20 0.56
SPHK1 Q9NYA1 2/20 0.56
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.47
FKBP1A P62942 4/20 0.47
NAAA Q02083 1/20 0.46
GYS1 P13807 4/20 0.45
NR4A2 P43354 1/20 0.44
KDM2B Q8NHM5 1/20 0.44

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
SCHEMBL7488179 0.84 SPHK2 (0.67) SPHK2SPHK1ALDH1A1GYS1
SCHEMBL7488792 0.76 KMT2A (0.57) ALDH1A1POLBFKBP1A
SCHEMBL6787454 0.73 FKBP1A (0.60) SPHK2SPHK1FKBP1A
SCHEMBL6787446 0.73 FKBP1A (0.60) SPHK2SPHK1FKBP1A
SCHEMBL4777773 0.70 SPHK2 (0.50) SPHK2SPHK1POLBNR4A2KDM2B
SCHEMBL4777767 0.70 SPHK2 (0.50) SPHK2SPHK1POLBNR4A2KDM2B
SCHEMBL12547447 0.69 FKBP1A (0.54) SPHK2SPHK1FKBP1A
SCHEMBL22688327 0.69 ALDH1A1 (0.72) SPHK2ALDH1A1NAAANR4A2KDM2B
SCHEMBL32665613 0.69 ALDH1A1 (0.72) SPHK2ALDH1A1NAAANR4A2KDM2B
SCHEMBL7492725 0.68 PTGIR (0.59) SPHK2SPHK1ALDH1A1NAAA

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 8 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
EP-0805681-A4 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1998-05-06 EP disclosed
EP-0805681-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 1997-11-12 EP disclosed
WO-1997003973-A1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-06 WO disclosed