SCHEMBL5043542

SCHEMBL5043542

COC(=O)CCc1cccc(CNC(c2ccc(-c3ccccc3)cc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.47
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
FFAR1 O14842 3/20 0.39
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
LMNA P02545 2/20 0.38
FFAR4 Q5NUL3 1/20 0.37
SENP1 Q9P0U3 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL5048092 0.84 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1
SCHEMBL5043595 0.81 PTPN1 (0.40) PTPN1KMT2AMEN1CA12CA7
SCHEMBL5046394 0.77 FFAR1 (0.54) PTPN1KMT2AMEN1FFAR1SIRT2
SCHEMBL5033493 0.76 PTPN1 (0.54) PTPN1KMT2AMEN1FFAR1CA12
SCHEMBL5043619 0.76 CYP19A1 (0.58) CA12CA7CA9CA14LMNA
SCHEMBL5046520 0.75 PTPN1 (0.47) PTPN1KMT2ACA12CA7CA9
SCHEMBL5043544 0.74 TAS2R14 (0.57) PTPN1CA12CA9TDP1
SCHEMBL9456168 0.74 PTPN1 (0.55) PTPN1FFAR1CA12CA7CA9
SCHEMBL5048111 0.73 ALDH1A1 (0.46) KMT2AMEN1FFAR1LMNAALDH1A1
SCHEMBL5039697 0.73 PTPN1 (0.54) PTPN1FFAR1CA12CA7CA9

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