SCHEMBL5004533

SCHEMBL5004533

C=CC(=O)OC1(CCC)C2CC3CC(C2)CC1(O)C3

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD11B1 P28845 1/20 0.31
EPHX2 P34913 2/20 0.30
THRB P10828 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
SCHEMBL5004543 0.90 HSD11B1 (0.32) MEN1KMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL677931 0.81 MEN1 (0.32) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL215042 0.76 THRB (0.36) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL5004827 0.76 SCN1A (0.31) HSD11B1
SCHEMBL685749 0.73 THRB (0.33) HPGDTSHRTHRB
SCHEMBL5004810 0.72 TSHR (0.30) TSHR
Acrylic Acid SCHEMBL28717242 0.72 HSD11B1 (0.34) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL4401909 0.71 HPGD (0.32) HPGDTSHRTHRB
SCHEMBL28319534 0.71 TSHR (0.39) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL14519261 0.71 HSD11B1 (0.38) HSD11B1THRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7452655-B2 Acrylic copolymer and radiation-sensitive resin composition JSR CORPORATION (JP) 2008-11-18 US disclosed
US-20060074139-A1 Acrylic copolymer and radiation-sensitive resin composition JSR CORPORATION (JP) 2006-04-06 US disclosed
EP-1586594-A1 ACRYLIC COPOLYMER AND RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2005-10-19 EP disclosed