SCHEMBL18905225

SCHEMBL18905225

COc1cc(N=Nc2cc3c(S(=O)(=O)O)cccc3cc2S(=O)(=O)O)c(C)cc1N=Nc1cc(OC)c(N=Nc2c(S(=O)(=O)O)cc3cc(Nc4ccccc4)ccc3c2O)cc1C

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 10/20 0.74
▸ PHLPP2 Q6ZVD8 2/20 0.46
▸ PRMT1 Q99873 2/20 0.45
▸ PRMT3 O60678 1/20 0.45
▸ EP300 Q09472 1/20 0.45
▸ PRMT6 Q96LA8 1/20 0.45
▸ CD40 P25942 1/20 0.42
▸ CD40LG P29965 1/20 0.42
▸ PTPN1 P18031 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CARM1 Q86X55 1/20 0.40

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
SCHEMBL18905228 0.93 ENPP2 (0.71) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL19234841 0.93 ENPP2 (0.81) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL19958178 0.93 ENPP2 (0.81) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL14773714 0.93 ENPP2 (0.81) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL17283952 0.93 ENPP2 (0.81) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL18910730 0.93 ENPP2 (0.81) ENPP2PHLPP2PRMT1PRMT3EP300
SCHEMBL17280468 0.92 ENPP2 (0.63) ENPP2PHLPP2PTPN1ALDH1A1HIF1A
SCHEMBL15935135 0.92 ENPP2 (0.63) ENPP2PHLPP2PTPN1ALDH1A1HIF1A
SCHEMBL19958117 0.92 ENPP2 (0.63) ENPP2PHLPP2PTPN1ALDH1A1HIF1A
SCHEMBL17540348 0.92 ENPP2 (0.79) ENPP2PHLPP2PRMT1PRMT3EP300

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-20170153361-A1 Achromatic Polarizing Plate With High-Transmissivity And High-Degree Of Polarization NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2017-06-01 — — US disclosed
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