SCHEMBL5046825

SCHEMBL5046825

COC(=O)CCc1cccc(CN(Cc2ccc(-c3ccccc3)cc2)S(=O)(=O)c2ccccn2)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 16/20 0.60
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL6059016 0.93 PTGER2 (0.53) PTGER2TDP1
SCHEMBL5043153 0.93 PTGER2 (0.53) PTGER2
SCHEMBL5050304 0.92 PTGER2 (0.52) PTGER2
SCHEMBL5050319 0.90 PTGER2 (0.62) PTGER2
SCHEMBL5046359 0.90 PTGER2 (0.50) PTGER2
SCHEMBL5048116 0.89 PTGER2 (0.60) PTGER2TDP1
SCHEMBL5046547 0.88 PTGER2 (0.49) PTGER2
SCHEMBL5043544 0.86 TAS2R14 (0.57) PTGER2TDP1
SCHEMBL5043099 0.85 PTGER2 (0.50) PTGER2TDP1
SCHEMBL5046372 0.84 TAS2R14 (0.54) TDP1

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
US-7442702-B2 Treatment of bone disorders; carboxy derivatives PFIZER INC. (US) 2008-10-28 US disclosed
EP-1021410-B1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER (US) 2006-12-27 EP disclosed
US-6498172-B1 (3-(((4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO)-METHYL) -PHENOXY)-ACETIC ACID OR SALT; TREATING SUCH AS OSTEOPOROSIS PFIZER INC. 2002-12-24 US disclosed
EP-1021410-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 2000-07-26 EP disclosed
WO-1999019300-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 1999-04-22 WO disclosed