SCHEMBL13291387

SCHEMBL13291387

O=S(=O)(c1ccc(F)cc1)c1ccc(I)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.47
RAPGEF4 Q8WZA2 1/20 0.47
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
MMP1 P03956 2/20 0.45
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
MMP8 P22894 2/20 0.45
MMP13 P45452 2/20 0.45
HTR2A P28223 5/20 0.44
KCNH2 Q12809 4/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 1/20 0.44
AKR1B1 P15121 1/20 0.43
CYP3A4 P08684 2/20 0.42
HTR6 P50406 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.42
MPO P05164 1/20 0.42

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
SCHEMBL896933 0.87 RAPGEF4 (0.56) RAPGEF4CA1CA2MMP1MMP2
SCHEMBL2121770 0.87 HSD11B1 (0.55) HSD11B1CA1CA2MMP1MMP2
SCHEMBL4328574 0.87 HSD11B1 (0.55) HSD11B1CA1CA2MMP1MMP2
SCHEMBL30072318 0.87 HSD11B1 (0.55) HSD11B1CA1CA2MMP1MMP2
SCHEMBL79787 0.87 HSD11B1 (0.55) HSD11B1CA1CA2MMP1MMP2
SCHEMBL9676951 0.80 RAPGEF4 (0.50) RAPGEF4CA1CA2MMP1MMP2
SCHEMBL5527318 0.80 PTGS2 (0.50) HSD11B1CA1CA2MMP1MMP2
SCHEMBL5518610 0.80 PTGS2 (0.50) HSD11B1CA1CA2MMP1MMP2
SCHEMBL2006278 0.80 PTGS2 (0.50) HSD11B1CA1CA2MMP1MMP2
SCHEMBL18472615 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105038764-B Based on the asymmetrical type hot activation delay aggregation induced luminescence material of diphenyl sulphone (DPS) phenoxazine structure and its synthetic method and application 中山大学 2017-09-29 CN claimed
CN-105038764-A Asymmetrical thermal-activation-delayed aggregation-induced emission material based on diphenyl sulfone phenoxazine, as well as synthesis method and application of material UNIV SUN YAT SEN 2015-11-11 CN claimed
CN-105038764-B Based on the asymmetrical type hot activation delay aggregation induced luminescence material of diphenyl sulphone (DPS) phenoxazine structure and its synthetic method and application 中山大学 2017-09-29 CN disclosed
CN-105038764-A Asymmetrical thermal-activation-delayed aggregation-induced emission material based on diphenyl sulfone phenoxazine, as well as synthesis method and application of material UNIV SUN YAT SEN 2015-11-11 CN disclosed
US-7727654-B2 Membrane of a sulfonated aromatic polymers having polyphenyl and polyphenylene ether units with fluorine and nitrile groups; higher proton conductivity over a wide temperature range, and exhibits superior hot water resistance, chemical stability, toughness and mechanical strength HONDA MOTOR CO., LTD. (JP) 2010-06-01 US disclosed
US-7727654-B2 Membrane of a sulfonated aromatic polymers having polyphenyl and polyphenylene ether units with fluorine and nitrile groups; higher proton conductivity over a wide temperature range, and exhibits superior hot water resistance, chemical stability, toughness and mechanical strength HONDA MOTOR CO., LTD. (JP) 2010-06-01 US disclosed