SCHEMBL6573589

SCHEMBL6573589

CC(C)CCNC(=O)[C@H](Cc1ccc(OC(C(=O)O)C(=O)O)cc1)NC(=O)CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.46
KDM4E B2RXH2 1/20 0.43
PTPN22 Q9Y2R2 1/20 0.43
FOLH1 Q04609 1/20 0.42
MME P08473 1/20 0.42
ACE P12821 1/20 0.42
CHRND Q07001 5/20 0.41
CHRNA1 P02708 1/20 0.41
CHRNG P07510 1/20 0.41
CHRNB1 P11230 1/20 0.41
KLKB1 P03952 1/20 0.41
KLK1 P06870 1/20 0.41

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
SCHEMBL6573593 1.00 PTPN1 (0.46) PTPN1KDM4EPTPN22FOLH1MME
SCHEMBL6575629 0.88 KLKB1 (0.46) PTPN1PTPN22FOLH1MMEKLKB1
SCHEMBL6575632 0.88 KLKB1 (0.46) PTPN1PTPN22FOLH1MMEKLKB1
SCHEMBL6571434 0.87 PTPN1 (0.62) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6572344 0.87 PTPN1 (0.62) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6571438 0.87 PTPN1 (0.62) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6571396 0.86 PTPN1 (0.61) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6571404 0.86 PTPN1 (0.61) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6575070 0.86 PTPN1 (0.61) PTPN1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL6575066 0.86 PTPN1 (0.61) PTPN1CHRNDCHRNA1CHRNGCHRNB1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019364-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 2000-07-19 EP claimed
WO-1999011606-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 1999-03-11 WO claimed
EP-1019364-B1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE BIOVITRUM AB (SE) 2004-06-09 EP disclosed
US-6410585-B1 THERAPY FOR NON-INSULIN DEPEND DIABETES BIOVITRUM AB (SE) 2002-06-25 US disclosed
US-6353023-B1 AROMATIC COMPOUNDS WITH AMIDE GROUPS PHARMACIA & UPJOHN COMPANY 2002-03-05 US disclosed
EP-1019364-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 2000-07-19 EP disclosed
WO-1999011606-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 1999-03-11 WO disclosed