SCHEMBL5841257

SCHEMBL5841257

O=C(O)c1c(NC2CCCCO2)sc2c1C[C@@H](CN1Cc3c(O)cccc3C1=O)NC2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAB7A P51149 1/20 0.31
CRBN Q96SW2 1/20 0.30

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
SCHEMBL7564422 0.89 PARP1 (0.39) RAB7A
SCHEMBL7564276 0.85 CYP1A2 (0.39) RAB7A
SCHEMBL5837650 0.83 PTPN1 (0.41)
SCHEMBL5838719 0.83 PTPN1 (0.41)
SCHEMBL7564458 0.82 PARP1 (0.37) RAB7A
SCHEMBL7542803 0.82 PARP1 (0.37) RAB7A
SCHEMBL7535281 0.80 PARP1 (0.36)
SCHEMBL7701502 0.75 HPGD (0.43) RAB7A
SCHEMBL5843765 0.74 ALDH1A1 (0.38) RAB7A
SCHEMBL7699460 0.73 NPC1 (0.48)

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-7115624-B1 Method of inhibiting protein tyrosine phosphatase 1B and/or T-cell protein tyrosine phosphatase 4 and/or other PTPases with an Asp residue at position 48 NOVO NORDISK A/S (DK) 2006-10-03 US disclosed
EP-1214060-A2 METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK A/S (DK) 2002-06-19 EP disclosed
WO-2001017516-A2 METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK A/S (DK) 2001-03-15 WO disclosed