SCHEMBL13088672

SCHEMBL13088672

COc1ccc(Nc2ccc3c(O)c(N=Nc4cc(C)c(N=Nc5cc(C)c(N=Nc6ccc(OC)cc6S(=O)(=O)O)cc5OC)cc4OC)c(SOOO)cc3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 10/20 0.55
▸ PRMT1 Q99873 2/20 0.40
▸ CARM1 Q86X55 1/20 0.40
▸ PTPN1 P18031 2/20 0.39
▸ PHLPP2 Q6ZVD8 1/20 0.39
▸ CD40 P25942 1/20 0.38
▸ CD40LG P29965 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ BRCA1 P38398 1/20 0.33

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
SCHEMBL13088668 1.00 ENPP2 (0.55) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL14001679 0.96 ENPP2 (0.60) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL14001676 0.96 ENPP2 (0.53) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL13088669 0.96 ENPP2 (0.49) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL13088671 0.95 ENPP2 (0.53) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL13088675 0.93 ENPP2 (0.48) ENPP2PRMT1CARM1PTPN1PHLPP2
SCHEMBL11911523 0.93 ENPP2 (0.55) ENPP2PRMT1CARM1PHLPP2CD40
SCHEMBL14001674 0.90 ENPP2 (0.45) ENPP2PRMT1CARM1PHLPP2CD40
SCHEMBL13088681 0.89 ENPP2 (0.46) ENPP2PRMT1CARM1PHLPP2CD40
SCHEMBL14001677 0.89 ENPP2 (0.51) ENPP2PRMT1CARM1PHLPP2CD40

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-20100257678-A1 Azo compound and dye polarizing film containing the same POLATECHNO CO., LTD. (JP) 2010-10-14 — — US disclosed
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