SCHEMBL17814026

SCHEMBL17814026

COc1cc(N=Nc2ccc3cc(S(=O)(=O)O)ccc3c2)c(C)cc1Nc1nc(SCCCS(=O)(=O)O)nc(SCCCS(=O)(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.43
▸ PTPRC P08575 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ PTPN6 P29350 1/20 0.34
▸ PTPN7 P35236 1/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ PTPRJ Q12913 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ DUSP26 Q9BV47 1/20 0.34
▸ PHLPP2 Q6ZVD8 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SNCA P37840 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ PRMT1 Q99873 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HIF1A Q16665 1/20 0.30

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
SCHEMBL17813983 0.91 ENPP2 (0.46) ENPP2PTPRCALOX15PTPN1PTPN6
SCHEMBL17813907 0.91 ENPP2 (0.43) ENPP2PTPRCALOX15PTPN1PTPN6
SCHEMBL17813973 0.88 ATIC (0.40) ENPP2POLBMAPTSNCACYP1A2
SCHEMBL17813912 0.86 ENPP2 (0.38) ENPP2
SCHEMBL17814018 0.84 ENPP2 (0.38) ENPP2
SCHEMBL17813898 0.83 SENP2 (0.35) ENPP2ALOX15HSD17B10POLBMAPT
SCHEMBL17813909 0.82 RAD52 (0.33) ENPP2POLBMAPTALDH1A1
SCHEMBL3656757 0.82 SENP2 (0.45) ENPP2MAPTSNCA
SCHEMBL14408044 0.82 SENP2 (0.45) ENPP2MAPTSNCA
SCHEMBL15233456 0.81 ENPP2 (0.42) ENPP2PTPRCALOX15PTPN1PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10190009-B2 Ink composition, ink jet recording method using same, and colored material NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2019-01-29 — — US disclosed
US-20160160065-A1 INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-06-09 — — US disclosed
Send feedback