SCHEMBL5837702

SCHEMBL5837702

CC(C)(C)OC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)(C)C)CCNC2C(=O)N1Cc2cccc(O[Si](C)(C)C(C)(C)C)c2C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 6/20 0.34
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31

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
SCHEMBL5837377 0.83 CXCR2 (0.36) CXCR2DDB1CRBN
SCHEMBL5837062 0.80 NT5E (0.37) CXCR2
SCHEMBL5836747 0.76 NT5E (0.38) CXCR2
SCHEMBL5837698 0.74 CXCR2 (0.38) CXCR2
SCHEMBL5837821 0.74 CXCR2 (0.42) CXCR2
SCHEMBL5837373 0.71 CXCR2 (0.36) CXCR2
SCHEMBL5837189 0.69 NT5E (0.34) CXCR2
SCHEMBL6315579 0.68 CXCR2 (0.44) CXCR2
SCHEMBL5837805 0.68 NT5E (0.41) CXCR2
SCHEMBL5837905 0.67 MAPT (0.38)

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-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-1214324-B1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK AS (DK) 2006-06-14 EP disclosed
US-6410556-B1 ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2002-06-25 US disclosed
EP-1214324-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2002-06-19 EP disclosed
WO-2001019830-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO disclosed