SCHEMBL5899547

SCHEMBL5899547

C=CC(=O)OCCCOc1ccc(C(C)(C)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.61
ALDH1A1 P00352 8/20 0.60
GAA P10253 2/20 0.60
KDM4E B2RXH2 10/20 0.58
SMN1; SMN2 Q16637 5/20 0.58
MEN1 O00255 6/20 0.57
KMT2A Q03164 6/20 0.57
HTT P42858 2/20 0.57
POLB P06746 2/20 0.55
LMNA P02545 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL28483790 0.97 THRB (0.61) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL26981899 0.96 THRB (0.59) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL246239 0.95 THRB (0.55) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL69516 0.93 THRB (0.71) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL11132915 0.92 THRB (0.55) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL7625535 0.91 THRB (0.51) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL21154699 0.91 TSHR (0.59) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL7630968 0.91 THRB (0.51) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL10033662 0.90 THRB (0.66) THRBALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL14173127 0.90 ALDH1A1 (0.52) THRBALDH1A1GAAKDM4ESMN1; SMN2

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-20060261318-A1 Light control film SUMITOMO CHEMICAL COMPANY, LIMITED 2006-11-23 US disclosed