SCHEMBL25784256

SCHEMBL25784256

C=C(C)C(=O)OCCOc1ccc(C(C)CC)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
ALDH1A1 P00352 3/20 0.55
TSHR P16473 1/20 0.55
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ACACB O00763 1/20 0.44
THRB P10828 1/20 0.44
HSP90AA1 P07900 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TP53 P04637 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
SCHEMBL23422510 0.89 TDP1 (0.47) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL31040362 0.88 TDP1 (0.51) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL381800 0.87 TDP1 (0.57) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL4451622 0.87 TDP1 (0.56) TDP1MEN1KMT2ATSHRPOLB
SCHEMBL548112 0.87 POLB (0.56) TDP1MEN1KMT2ATSHRPOLB
SCHEMBL16620120 0.86 TDP1 (0.55) TDP1MEN1KMT2ATSHRPOLB
SCHEMBL15698361 0.85 TDP1 (0.57) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL454606 0.85 POLB (0.67) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL25784268 0.83 THRB (0.44) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL13636409 0.83 TDP1 (0.52) TDP1MEN1KMT2ATSHRPOLB

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