SCHEMBL5043218

SCHEMBL5043218

O=C(O)CCc1cccc(CN(Cc2cc3ccccc3o2)S(=O)(=O)c2ccc(F)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
TAS2R14 Q9NYV8 7/20 0.49
PTGER2 P43116 2/20 0.47
MEP1B Q16820 1/20 0.45
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42

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
SCHEMBL5047891 0.93 PTGER2 (0.52) KMT2ATAS2R14PTGER2MEN1HTT
SCHEMBL5043219 0.90 TAS2R14 (0.45) KMT2ATAS2R14PTGER2MEP1BMEN1
SCHEMBL5043600 0.83 PTGER2 (0.49) KMT2ATAS2R14PTGER2MEN1PTGES
SCHEMBL5043270 0.78 TAS2R14 (0.64) KMT2ATAS2R14MEP1BMEN1PTGES
SCHEMBL5043143 0.76 KMT2A (0.51) KMT2ATAS2R14MEP1B
SCHEMBL5725296 0.74 PTGER2 (0.45) KMT2APTGER2MEN1
SCHEMBL4943463 0.74 PTGER2 (0.69) PTGER2
SCHEMBL5043193 0.74 TAS2R14 (0.56) KMT2ATAS2R14MEP1BMEN1CNR2
SCHEMBL27509041 0.72 TAS2R14 (0.62) KMT2ATAS2R14MEP1BMEN1HTT
SCHEMBL8211693 0.72 PTGER2 (0.46) KMT2ATAS2R14PTGER2MEN1HTT

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 3 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