SCHEMBL14141470

SCHEMBL14141470

C=C(C)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(/N=N/c4cc(NC(=C)C)ccc4S(=O)(=O)O)c(O)c3c2N)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ PRMT1 Q99873 2/20 0.43
▸ THRB P10828 1/20 0.41
▸ PRMT3 O60678 1/20 0.41
▸ EP300 Q09472 1/20 0.41
▸ PRMT6 Q96LA8 1/20 0.41
▸ FUT8 Q9BYC5 1/20 0.41
▸ CD40 P25942 1/20 0.41
▸ CD40LG P29965 1/20 0.41
▸ CYP2C9 P11712 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ DNASE1L3 Q13609 1/20 0.40
▸ PHLPP2 Q6ZVD8 1/20 0.40
▸ CA2 P00918 1/20 0.39
▸ CA3 P07451 1/20 0.39

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
SCHEMBL14223670 0.91 PRMT1 (0.51) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL8816878 0.81 ENPP2 (0.54) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL8816868 0.81 ENPP2 (0.54) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL13541420 0.81 ENPP2 (0.41) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL12172924 0.81 ENPP2 (0.43) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL14045325 0.79 FUT8 (0.60) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL14223300 0.78 ENPP2 (0.41) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL14193701 0.77 PRMT3 (0.40) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL18218261 0.77 PRMT1 (0.56) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL13366713 0.77 FUT8 (0.47) ENPP2MEN1HTTKMT2ACYP1A2

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
EP-1717283-B1 Ink composition containing a particular type of dye, and corresponding ink jet printing process. AGFA GRAPHICS NV (BE) 2008-07-16 — — EP disclosed
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