SCHEMBL18356798

SCHEMBL18356798

CCC(C)(C)C(=O)Oc1cccc2c(OC(=O)C3CCC4OC4C3)cccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ESR1 P03372 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ POLB P06746 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RIPK1 Q13546 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ EPHX2 P34913 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL18643594 0.89 MEN1 (0.41) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL18356133 0.87 POLB (0.42) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL15978734 0.84 HTT (0.40) KMT2APOLBSMN1; SMN2TSHRHTT
SCHEMBL18356797 0.81 KMT2A (0.44) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL14884059 0.81 BCHE (0.35) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL14665378 0.78 L3MBTL1 (0.42) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL14665279 0.78 MEN1 (0.42) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL18356132 0.77 KDM4E (0.44) MEN1KMT2ARAB9AL3MBTL1ESR1
SCHEMBL14884054 0.76 LMNA (0.35) RAB9AL3MBTL1ALDH1A1GAASMN1; SMN2
SCHEMBL18356772 0.76 MEN1 (0.41) MEN1KMT2ARAB9AL3MBTL1ESR1

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-20170005266-A1 SEMICONDUCTOR ELEMENT AND INSULATING LAYER-FORMING COMPOSITION FUJIFILM CORPORATION (JP) 2017-01-05 — — US disclosed
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