SCHEMBL11094830

SCHEMBL11094830

Cc1ccc(C2=C(OC(=O)OCc3ccccc3)CC(C)(C)CC2=O)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ PTGER1 P34995 1/20 0.35

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
SCHEMBL11093637 0.87 BRD4 (0.38) KDM4EGAAALDH1A1MEN1KMT2A
SCHEMBL11099865 0.86 BRD4 (0.43) BRD4L3MBTL1MAOBFFAR1
SCHEMBL11094187 0.81 MAPK1 (0.35) KDM4EGLAGAATSHRALDH1A1
SCHEMBL11098282 0.80 BRD4 (0.37) KDM4EGAAALDH1A1MEN1KMT2A
SCHEMBL11096939 0.80 BRD4 (0.31) KDM4EGLANPC1RAB9ABRD4
SCHEMBL11098604 0.79 BRD4 (0.35) KDM4EGLAGAAALDH1A1MEN1
SCHEMBL11098815 0.79 TP53 (0.35) KDM4EHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL10735397 0.77 KDM4E (0.37) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10911409 0.77 BRD4 (0.35) KDM4EGAAALDH1A1MEN1KMT2A
SCHEMBL11097162 0.76 BRD4 (0.40) KDM4EGAAALDH1A1MEN1KMT2A

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-4436666-A HERBICIDES, MITICIDWS UNION CARBIDE CORPORATION (US) 1984-03-13 — — US disclosed
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