SCHEMBL9145308

SCHEMBL9145308

O=C(c1ccc(O)cc1)c1sc2ccc(O)cc2c1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.61
CLK1 P49759 2/20 0.46
DYRK1A Q13627 2/20 0.46
DYRK1B Q9Y463 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
MAOB P27338 2/20 0.45
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
CHEK1 O14757 1/20 0.43
WEE1 P30291 1/20 0.43
USP2 O75604 1/20 0.42
GAA P10253 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL8341113 0.97 ESR1 (0.62) ESR1CLK1DYRK1ADYRK1BMEN1
SCHEMBL11598721 0.96 ESR1 (0.56) ESR1CLK1DYRK1ADYRK1BMEN1
SCHEMBL8341396 0.89 ESR1 (0.76) ESR1CLK1DYRK1ADYRK1BMEN1
SCHEMBL8338493 0.89 ESR1 (0.60) ESR1MEN1KMT2ARAB9ALMNA
SCHEMBL11599689 0.84 ESR1 (0.71) ESR1CLK1DYRK1ADYRK1BMEN1
SCHEMBL7506018 0.82 ESR1 (0.59) ESR1MEN1KMT2ARAB9ALMNA
SCHEMBL11600001 0.82 ESR1 (0.67) ESR1
SCHEMBL11599683 0.80 MAOB (0.59) MEN1KMT2ARAB9AMAPTMAOB
SCHEMBL11599731 0.80 MAOB (0.53) ESR1CLK1DYRK1ADYRK1BMAOB
SCHEMBL8338171 0.78 ESR1 (0.63) ESR1CLK1DYRK1ADYRK1BMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5445941-A Using nucleic acids from the promoter regions of transforming growth factor beta genes comprising novel regulatory elements designated \"raloxifene responsive elements\ ELI LILLY AND COMPANY (US) 1995-08-29 US disclosed
US-4075227-A NONSTEROIDAL ELI LILLY AND COMPANY (US) 1978-02-21 US disclosed