SCHEMBL6572984

SCHEMBL6572984

CCCCCNC(=O)[C@H](Cc1ccc(OC(C(=O)O)C(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCCCC

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.55
GRIA1 P42261 2/20 0.54
ITGB3 P05106 2/20 0.49
ITGA2B P08514 2/20 0.49
CHRND Q07001 5/20 0.48
CHRNA1 P02708 1/20 0.48
CHRNG P07510 1/20 0.48
CHRNB1 P11230 1/20 0.48

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
SCHEMBL6571541 0.96 PTPN1 (0.59) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6572533 0.94 PTPN1 (0.56) PTPN1GRIA1ITGB3ITGA2BCHRND
SCHEMBL6572536 0.94 PTPN1 (0.56) PTPN1GRIA1ITGB3ITGA2BCHRND
SCHEMBL6571434 0.91 PTPN1 (0.62) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6572344 0.91 PTPN1 (0.62) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6571438 0.91 PTPN1 (0.62) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6574908 0.91 PTPN1 (0.66) PTPN1GRIA1CHRND
SCHEMBL6575066 0.91 PTPN1 (0.61) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6575070 0.91 PTPN1 (0.61) PTPN1GRIA1CHRNDCHRNA1CHRNG
SCHEMBL6571404 0.91 PTPN1 (0.61) PTPN1GRIA1CHRNDCHRNA1CHRNG

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