SCHEMBL22651232

SCHEMBL22651232

CC(=O)Oc1ccc(C2(c3ccc(O)c(C)c3)c3ccccc3-c3ccccc32)cc1C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.70
ESR2 Q92731 3/20 0.70
MAPT P10636 7/20 0.48
MEN1 O00255 3/20 0.48
LMNA P02545 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
XBP1 P17861 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 3/20 0.38
HTT P42858 2/20 0.38
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ADORA3 P0DMS8 2/20 0.36

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
SCHEMBL3031970 0.89 ESR1 (0.65) ESR1ESR2MAPTMEN1LMNA
SCHEMBL822520 0.89 ESR1 (0.52) ESR1ESR2MAPTHTTNPC1
SCHEMBL13072627 0.87 ESR1 (0.65) ESR1ESR2MAPTMEN1LMNA
SCHEMBL23034829 0.86 ESR1 (0.64) ESR1ESR2MAPTMEN1LMNA
SCHEMBL14287530 0.85 ESR1 (0.49) ESR1ESR2MAPTMEN1KMT2A
SCHEMBL21075509 0.85 ESR1 (0.49) ESR1ESR2MAPTMEN1LMNA
SCHEMBL1847909 0.84 ESR1 (0.78) ESR1ESR2MAPTMEN1LMNA
SCHEMBL29462974 0.84 ESR1 (0.78) ESR1ESR2MAPTMEN1LMNA
SCHEMBL21405708 0.84 ESR1 (0.61) ESR1ESR2MAPTMEN1LMNA
SCHEMBL21405706 0.84 ESR1 (0.61) ESR1ESR2MAPTMEN1LMNA

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-20200354512-A1 POLYMER, COMPOSITION, MOLDED ARTICLE, CURED PRODUCT, AND LAMINATE JSR CORPORATION (JP) 2020-11-12 US disclosed