SCHEMBL11044755

SCHEMBL11044755

O=C(SN1CCOCC1)SN1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.50
CA12 O43570 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
FAAH O00519 1/20 0.36
PHGDH O43175 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALDH2 P05091 1/20 0.36

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
SCHEMBL30709623 0.92 MGLL (0.48) MGLLCA12SMN1; SMN2CA1CA9
SCHEMBL10560780 0.82 MGLL (0.48) MGLLCA12SMN1; SMN2CA1CA9
SCHEMBL5175953 0.80 MGLL (0.46) MGLLCA12SMN1; SMN2CA1CA9
SCHEMBL11825229 0.77 MGLL (0.34) MGLLHSD17B10KDM4EL3MBTL1ALOX15
SCHEMBL4066337 0.75 MGLL (0.41) MGLLCA12SMN1; SMN2CA1CA9
SCHEMBL16162461 0.71 SMN1; SMN2 (0.53) MGLLSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL29141222 0.70 MGLL (0.46) MGLLCA12SMN1; SMN2CA1CA9
SCHEMBL27924627 0.70 MGLL (0.46) MGLLCA12CA1CA9KDM4E
SCHEMBL7757291 0.69 TSHR (0.50) SMN1; SMN2MEN1KMT2AHSD17B10TSHR
SCHEMBL15083670 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0128890-A2 Sulphur-containing polymers useful as stabilising agents for rubber vulcanisates MONSANTO EUROPE S.A./N.V. (BE) 1984-12-19 EP disclosed
EP-0004711-A2 Process for the cross-linking of polymers Vulnax International Limited (GB) 1979-10-17 EP disclosed