SCHEMBL5551062

SCHEMBL5551062

CS(=O)(=O)OCCCNCCCCN

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.52
▸ TSHR P16473 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ MMP9 P14780 1/20 0.52
▸ CA12 O43570 3/20 0.48
▸ CA2 P00918 3/20 0.48
▸ CA4 P22748 3/20 0.48
▸ CA6 P23280 3/20 0.48
▸ CA5A P35218 3/20 0.48
▸ CA7 P43166 3/20 0.48
▸ CA9 Q16790 3/20 0.48
▸ CA14 Q9ULX7 3/20 0.48
▸ CA5B Q9Y2D0 3/20 0.48
▸ F13A1 P00488 2/20 0.48
▸ CYP1A2 P05177 2/20 0.48
▸ THPO P40225 2/20 0.48
▸ CA3 P07451 2/20 0.48

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
SCHEMBL27700119 0.90 TSHR (0.64) ALOX15TSHRLMNAKDM4EUSP2
Improsulfan SCHEMBL27654142 0.88 TSHR (0.61) ALOX15TSHRLMNAKDM4EUSP2
Improsulfan SCHEMBL8954 0.88 USP2 (0.67) ALOX15TSHRLMNAKDM4EUSP2
Improsulfan SCHEMBL5886799 0.86 TSHR (0.71) ALOX15TSHRLMNAKDM4EUSP2
Improsulfan SCHEMBL10628525 0.86 USP2 (0.64) ALOX15TSHRLMNAKDM4EUSP2
Improsulfan SCHEMBL844581 0.86 USP2 (0.64) ALOX15TSHRLMNAKDM4EUSP2
SCHEMBL25120968 0.81 TSHR (0.71) ALOX15TSHRLMNAKDM4EUSP2
SCHEMBL18012765 0.81 TSHR (0.71) ALOX15TSHRLMNAKDM4EUSP2
SCHEMBL7535906 0.81 TSHR (0.71) ALOX15TSHRLMNAKDM4EUSP2
SCHEMBL16230093 0.81 — —

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-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 — — US claimed
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