SCHEMBL11501160

SCHEMBL11501160

O=[PH2]OCC(=O)COc1cccs1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ RAB9A P51151 4/20 0.33
▸ NPC1 O15118 4/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ POLB P06746 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ ELANE P08246 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CES2 O00748 1/20 0.32
▸ CES1 P23141 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32

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
SCHEMBL341114 0.75 ALOX15 (0.50) HPGDKMT2APOLBMEN1ALDH1A1
SCHEMBL707494 0.75 KDM4E (0.44) HPGDMMP1MMP2MMP9MMP12
SCHEMBL724289 0.74 GSK3B (0.40) HPGDMMP1MMP2MMP9MMP12
SCHEMBL11008232 0.74 KMT2A (0.39) HPGDMMP1MMP2MMP9MMP12
SCHEMBL891160 0.73 MMP1 (0.44) HPGDMMP1MMP2MMP9MMP12
Potassium Ion SCHEMBL11800653 0.73 HPGD (0.37) HPGDMMP1MMP2MMP9MMP12
SCHEMBL8814468 0.71 KMT2A (0.51) HPGDRAB9ANPC1KMT2AMEN1
SCHEMBL11431451 0.70 KMT2A (0.40) HPGDRAB9ANPC1KMT2APOLB
SCHEMBL3722741 0.70 TDP1 (0.32) —
SCHEMBL5759533 0.69 L3MBTL1 (0.39) HPGDMMP1MMP2MMP9MMP12

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-0012072-A2 Beta-lactones derived from 2-hydroxycyclopentane carboxylic acid, process for their preparation and pharmaceutical compositions containing them ROUSSEL-UCLAF (FR) 1980-06-11 — — EP disclosed
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