SCHEMBL13498485

SCHEMBL13498485

COC(=O)c1cc(OCc2cc(C)cc(C)c2)cc(OCc2cc(C)cc(C)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 1/20 0.55
▸ SLC7A5 Q01650 1/20 0.48
▸ CNR2 P34972 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ HPGD P15428 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA14 Q9ULX7 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MRGPRX4 Q96LA9 2/20 0.45
▸ MAOB P27338 1/20 0.44

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
SCHEMBL13945260 0.82 CA12 (0.56) HPGDLMNACA12CA1CA2
SCHEMBL13498486 0.82 PARP10 (0.50) PARP10CNR2HDAC8CA12CA1
SCHEMBL7362723 0.82 HPGD (0.63) HPGDLMNAMAPTMEN1KMT2A
SCHEMBL391547 0.81 MEN1 (0.71) PARP10HPGDLMNAMAPTMEN1
SCHEMBL13945262 0.81 CA12 (0.55) HPGDLMNACA12CA1CA2
SCHEMBL14456118 0.80 PARP10 (0.55) PARP10HDAC8SMN1; SMN2MAOBALKBH1
SCHEMBL5382299 0.80 LMNA (0.43) HPGDLMNACA12CA1CA2
SCHEMBL3604210 0.79 MAOB (0.55) PARP10HPGDLMNACA12CA1
SCHEMBL13498482 0.78 PARP10 (0.53) PARP10HDAC8SMN1; SMN2MAOBALKBH1
SCHEMBL14456120 0.78 PARP10 (0.53) PARP10HDAC8SMN1; SMN2MAOBALKBH1

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-20100036054-A1 NOVEL SURFACE ACTIVE POLYMERIC SYSTEMS UNIVERSITY OF DURHAM (GB) 2010-02-11 — — US disclosed
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