SCHEMBL8105854

SCHEMBL8105854

C[C@H](C(=O)O)N(Cc1ccccn1)S(=O)(=O)[N+]1(O)CCc2c([nH]c3ccccc23)C1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.44
FNTB P49356 3/20 0.44
NMBR P28336 7/20 0.36
KDR P35968 1/20 0.34
PARP1 P09874 1/20 0.34
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
PTPRA P18433 1/20 0.33
ADAMTS4 O75173 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL4670970 0.78 FNTA (0.44) FNTAFNTBKDR
SCHEMBL4670972 0.78 FNTA (0.44) FNTAFNTBKDR
SCHEMBL8105859 0.64 ABCB1 (0.45) FNTAFNTBMAPTKMT2A
SCHEMBL1065198 0.64 PTPRA (0.53) FNTAFNTBMAPTPTPRAKMT2A
SCHEMBL6573455 0.62 PTPRA (0.50) FNTAFNTBMAPTPTPRAKMT2A
SCHEMBL6668651 0.61 FNTA (1.00) FNTAFNTB
SCHEMBL6668444 0.60 FNTA (1.00) FNTAFNTB
SCHEMBL8105746 0.60 HDAC3 (0.49) LMNAMAPT
SCHEMBL10127528 0.60 KMT2A (0.51) LMNAMAPTKMT2A
SCHEMBL15016414 0.59 L3MBTL1 (0.46) FNTAFNTBLMNAMAPTKMT2A

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-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed