SCHEMBL6265485

SCHEMBL6265485

O=C(O)COc1c(C(=O)O)sc(-c2cccc(OCCc3ccccc3)c2)c1Cl

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.64
PTPRC P08575 1/20 0.51
PTPN2 P17706 1/20 0.51
NR1H4 Q96RI1 1/20 0.45
FFAR1 O14842 1/20 0.43

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
SCHEMBL3907472 0.91 PTPN1 (0.77) PTPN1PTPRCPTPN2FFAR1
SCHEMBL3907610 0.90 PTPN1 (0.65) PTPN1PTPRCPTPN2
SCHEMBL6268054 0.89 PTPN1 (0.59) PTPN1PTPRCPTPN2
SCHEMBL6262486 0.88 PTPN1 (0.64) PTPN1PTPRCPTPN2NR1H4FFAR1
SCHEMBL6268410 0.88 PTPN1 (0.83) PTPN1PTPRCPTPN2
SCHEMBL3907645 0.86 PTPN1 (0.76) PTPN1PTPRCPTPN2
SCHEMBL3909638 0.85 PTPN1 (0.66) PTPN1
SCHEMBL3907751 0.84 PTPN1 (0.60) PTPN1PTPRCPTPN2
SCHEMBL3909147 0.84 PTPN1 (0.65) PTPN1PTPRCPTPN2FFAR1
SCHEMBL3910993 0.84 PTPN1 (0.56) PTPN1PTPRCPTPN2

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