SCHEMBL14444825

SCHEMBL14444825

CNc1ccc(/N=N/c2ccc3cc(SOOO)cc(S(=O)(=O)O)c3c2)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.45
▸ ENPP2 Q13822 2/20 0.40
▸ PTGS2 P35354 2/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ PTGS1 P23219 2/20 0.33
▸ MPL P40238 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PHLPP2 Q6ZVD8 1/20 0.32
▸ SENP2 Q9HC62 2/20 0.32
▸ SENP1 Q9P0U3 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL14467497 0.83 ENPP2 (0.53) PTPN11ENPP2PTGS2MEN1KMT2A
SCHEMBL12975929 0.80 ENPP2 (0.49) PTPN11ENPP2MEN1KMT2ASENP2
SCHEMBL13100754 0.80 PTPN11 (0.38) PTPN11ENPP2
SCHEMBL12998811 0.80 PTPN11 (0.38) PTPN11ENPP2
SCHEMBL13388663 0.78 PTPN11 (0.39) PTPN11ENPP2PTGS2PHLPP2BRD4
SCHEMBL14407942 0.77 PTPN11 (0.36) PTPN11ENPP2
SCHEMBL13100756 0.77 PTPN11 (0.36) PTPN11ENPP2
SCHEMBL14357504 0.77 ENPP2 (0.48) PTPN11ENPP2MEN1KMT2APHLPP2
SCHEMBL12391792 0.75 PTPN11 (0.36) PTPN11ENPP2ALDH1A1
SCHEMBL13239212 0.75 PTPN11 (0.50) PTPN11ENPP2MEN1KMT2AMPL

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-7247195-B2 Dye sets for ink-jet ink imaging HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-07-24 — — US disclosed
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