SCHEMBL25784271

SCHEMBL25784271

C=CC(=O)OCCCOc1ccc(C(C)CC)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 4/20 0.54
TSHR P16473 3/20 0.54
HPGD P15428 1/20 0.51
THRB P10828 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CYP3A4 P08684 1/20 0.44
HSP90AA1 P07900 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPK1 P28482 1/20 0.42

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
SCHEMBL25784262 0.93 THRB (0.60) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL8031168 0.88 THRB (0.56) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL25784278 0.85 TSHR (0.46) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL15958509 0.85 THRB (0.51) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL25784279 0.85 TSHR (0.47) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL13906793 0.83 THRB (0.54) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL25784259 0.82 TSHR (0.45) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL14565943 0.82 TSHR (0.51) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL27015531 0.81 THRB (0.51) MEN1KMT2ATDP1ALDH1A1TSHR
SCHEMBL13784561 0.81 THRB (0.57) MEN1KMT2ATDP1ALDH1A1TSHR

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-20230217718-A1 METHOD FOR PRODUCING LIGHT-EMITTING ELEMENTS CENTRAL GLASS COMPANY, LIMITED (JP) 2023-07-06 US disclosed