SCHEMBL14519962

SCHEMBL14519962

O=C(OCc1ccccc1)C(CCCOC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 10/20 0.52
▸ CDC25B P30305 8/20 0.52
▸ PTPN2 P17706 6/20 0.52
▸ PTPN11 Q06124 5/20 0.52
▸ PTPN6 P29350 4/20 0.52
▸ NT5E P21589 1/20 0.50
▸ SSTR1 P30872 5/20 0.49
▸ SSTR2 P30874 5/20 0.49
▸ SSTR4 P31391 5/20 0.49
▸ SSTR3 P32745 5/20 0.49
▸ SSTR5 P35346 5/20 0.49
▸ TACR1 P25103 2/20 0.46
▸ ADRB2 P07550 1/20 0.45

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
SCHEMBL7588437 0.84 PTPN1 (0.50) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL9954434 0.83 TACR1 (0.53) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL10951219 0.83 NT5E (0.54) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL2292522 0.82 SSTR1 (0.56) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL12380725 0.82 SSTR1 (0.56) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6889266 0.82 SSTR1 (0.56) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL5556504 0.82 SSTR1 (0.57) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6139789 0.82 SSTR1 (0.57) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL8507196 0.82 SSTR1 (0.57) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL13410500 0.82 PTPN1 (0.49) PTPN1CDC25BPTPN2PTPN11PTPN6

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
US-7208611-B2 Platinum-containing compounds exhibiting cytostatic activity, synthesis and methods of use XENOPORT, INC. (US) 2007-04-24 — — US disclosed
Send feedback