SCHEMBL5046930

SCHEMBL5046930

Cn1cnc(S(=O)(=O)N(Cc2ccc(-c3ncccn3)cc2)Cc2cccc(CCC(=O)O)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
FNTA P49354 7/20 0.44
FNTB P49356 7/20 0.44
PGGT1B P53609 5/20 0.44
PTGER2 P43116 4/20 0.43
TLR7 Q9NYK1 1/20 0.43
PPARG P37231 1/20 0.40

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
SCHEMBL5043018 0.91 TLR7 (0.50) MEN1KMT2ANR1H2NR1H3FNTA
SCHEMBL6058775 0.91 MEN1 (0.49) MEN1KMT2ANR1H2NR1H3FNTA
SCHEMBL5048029 0.89 FFAR1 (0.47) MEN1KMT2ANR1H2NR1H3FNTA
SCHEMBL5046352 0.87 FNTA (0.45) MEN1KMT2ANR1H2NR1H3FNTA
SCHEMBL8211041 0.86 CA12 (0.52) MEN1KMT2ANR1H2NR1H3PTGER2
Hydrochloric Acid SCHEMBL5046437 0.85 CA12 (0.51) MEN1KMT2ANR1H2NR1H3PTGER2
SCHEMBL5049429 0.85 PTGER2 (0.55) PTGER2
SCHEMBL5050570 0.84 PTGER2 (0.51) MEN1KMT2ANR1H2NR1H3FNTA
SCHEMBL5046836 0.83 TAS2R14 (0.53) MEN1KMT2A
SCHEMBL5043195 0.80 TLR7 (0.47) MEN1KMT2ANR1H2NR1H3FNTA

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