SCHEMBL29217059

SCHEMBL29217059

C=C(C)C(=O)OC(C)OCCOc1ccccc1.C=CC(=O)OC(C)OCCOc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
MTNR1A P48039 4/20 0.38
MTNR1B P49286 4/20 0.38
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 3/20 0.37
RAB9A P51151 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER2 P43116 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 3/20 0.36

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
SCHEMBL449799 0.91 THRB (0.61) THRBALDH1A1MEN1KMT2ANPSR1
SCHEMBL1264240 0.91 MTNR1A (0.44) THRBALDH1A1MEN1KMT2ANPSR1
Phenol SCHEMBL29231472 0.86 THRB (0.56) THRBALDH1A1MEN1KMT2ANPSR1
SCHEMBL10836550 0.85 THRB (0.57) THRBALDH1A1MEN1KMT2ATDP1
SCHEMBL18426495 0.84 THRB (0.56) THRBALDH1A1MEN1KMT2ANPSR1
SCHEMBL28932859 0.84 THRB (0.52) THRBALDH1A1PKMMAPTSMN1; SMN2
SCHEMBL9994926 0.82 THRB (0.39) THRBALDH1A1MEN1KMT2AMTNR1A
SCHEMBL11123924 0.80 THRB (0.68) THRBALDH1A1MEN1KMT2ANPSR1
SCHEMBL16359346 0.79 TSHR (0.38) THRBALDH1A1TDP1POLBAPEX1
SCHEMBL29217060 0.79 THRB (0.37) THRBALDH1A1MEN1KMT2AMTNR1A

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
CN-118085183-B Method for improving refractive index difference of holographic material, photopolymer composition and grating 奥提赞光晶(上海)显示技术有限公司 2024-07-05 CN disclosed
CN-118085183-A Method for improving refractive index difference of holographic material, photopolymer composition and grating 奥提赞光晶(上海)显示技术有限公司 2024-05-28 CN disclosed