SCHEMBL11052364

SCHEMBL11052364

[CH2]C(=O)c1ccccc1OCCCC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
KMT2A Q03164 4/20 0.62
MAPT P10636 2/20 0.62
MEN1 O00255 2/20 0.62
CYP3A4 P08684 2/20 0.62
NR1I2 O75469 1/20 0.62
CHRM2 P08172 1/20 0.62
ADRA2A P08913 1/20 0.62
OPRK1 P41145 1/20 0.62
HTR2B P41595 1/20 0.62
SLC6A3 Q01959 1/20 0.62
HDAC6 Q9UBN7 1/20 0.62
L3MBTL1 Q9Y468 2/20 0.55
TSHR P16473 3/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 3/20 0.53
NPSR1 Q6W5P4 1/20 0.52
THRB P10828 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
CYP1A2 P05177 1/20 0.51

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
SCHEMBL15766685 0.93 LMNA (0.72) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL11050232 0.91 LMNA (0.55) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL9898531 0.86 LMNA (0.66) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL50006 0.84 LMNA (0.64) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL8154526 0.84 LMNA (0.74) LMNAKMT2AMAPTMEN1CYP3A4
Benzene SCHEMBL28006345 0.84 KMT2A (0.69) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL29994009 0.84 KMT2A (0.69) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL301123 0.84 KMT2A (0.69) LMNAKMT2AMAPTMEN1CYP3A4
SCHEMBL10573700 0.84 HCRTR1 (0.62) LMNAKMT2AMAPTMEN1L3MBTL1
SCHEMBL7956577 0.83 LMNA (0.59) LMNAKMT2AMAPTMEN1CYP3A4

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-4438277-A Hydronaphthalene derivatives SANKYO COMPANY, LIMITED (JP) 1984-03-20 US disclosed
US-4361515-A Antihyperlipemic dihydro-ML-236B derivatives, their preparation and use SANKYO COMPANY, LIMITED (JP) 1982-11-30 US disclosed