SCHEMBL21895267

SCHEMBL21895267

O=C(CCCCC1CCSCC1)ON1C(=O)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 3/20 0.36
▸ HPGD P15428 7/20 0.34
▸ PSMB8 P28062 1/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL24622843 0.87 NAAA (0.47) NAAAHPGDPSMB8KMT2A
SCHEMBL21664445 0.86 NAAA (0.49) NAAAHPGDPSMB8
SCHEMBL18779827 0.84 NAAA (0.51) NAAAHPGDKMT2A
SCHEMBL20801422 0.84 NAAA (0.51) NAAAHPGDKMT2A
SCHEMBL24860007 0.84 NAAA (0.51) NAAAHPGDKMT2A
SCHEMBL22181049 0.84 NAAA (0.51) NAAAHPGDKMT2A
SCHEMBL290461 0.80 SMN1; SMN2 (0.40) HPGDPSMB8KMT2ASMN1; SMN2
SCHEMBL22840773 0.78 HSD17B10 (0.33) NAAAPSMB8KMT2ASMN1; SMN2
SCHEMBL12972729 0.78 HSD17B10 (0.55) KMT2A
SCHEMBL2633200 0.78 HSD17B10 (0.55) KMT2A

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-3626820-A1 ANTICANCER COMPOSITIONS CONTAINING MIRNA MIMICS AND USES THEREOF Fundación Imdea Nanociencia (ES) 2020-03-25 — — EP disclosed
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