SCHEMBL6265656

SCHEMBL6265656

O=C(O)CC(Oc1c(-c2nn[nH]n2)sc(-c2cccc(NC3CCCCC3)c2)c1Cl)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 14/20 0.68
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL3908002 0.90 PTPN1 (0.83) PTPN1
Acetic Acid SCHEMBL6265652 0.87 PTPN1 (0.79) PTPN1
SCHEMBL3907459 0.81 PTPN1 (1.00) PTPN1
SCHEMBL3909575 0.81 PTPN1 (0.82) PTPN1
SCHEMBL3910911 0.78 PTPN1 (0.66) PTPN1MEN1POLBKMT2A
SCHEMBL3907306 0.77 PTPN1 (0.84) PTPN1
SCHEMBL3913254 0.76 PTPN1 (0.86) PTPN1
SCHEMBL3911886 0.74 PTPN1 (0.81) PTPN1
SCHEMBL6264534 0.73 PTPN1 (0.61) PTPN1MEN1POLBKMT2A
SCHEMBL6264526 0.73 PTPN1 (0.61) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 WO disclosed