SCHEMBL16950293

SCHEMBL16950293

C=CC(=O)OC(=O)CCCCCCCN

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
PLG P00747 1/20 0.43
ALOX15 P16050 1/20 0.43
SLC6A2 P23975 1/20 0.43
RECQL P46063 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PAOX Q6QHF9 2/20 0.42
TSHR P16473 7/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.40
NFKB1 P19838 1/20 0.40
BLM P54132 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 2/20 0.38
HPGD P15428 1/20 0.33
TP53 P04637 2/20 0.32

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
SCHEMBL6157876 1.00 ALDH1A1 (0.43) ALDH1A1LMNATHRBKMT2AMEN1
SCHEMBL17337913 0.98 ALDH1A1 (0.42) ALDH1A1LMNATHRBKMT2AMEN1
SCHEMBL2776924 0.90 TSHR (0.48) ALDH1A1LMNATSHRCYP3A4HPGD
SCHEMBL28495861 0.88 TSHR (0.44) ALDH1A1LMNATSHRCYP3A4HPGD
SCHEMBL6157826 0.84 TSHR (0.37) ALDH1A1THRBTSHRCYP3A4CYP1A2
SCHEMBL588136 0.83 TSHR (0.44) ALDH1A1LMNATHRBTSHRCYP3A4
SCHEMBL3347194 0.82 ABCC4 (0.50) ALDH1A1LMNATHRBKMT2AMEN1
SCHEMBL4758861 0.81 LMNA (0.56) ALDH1A1LMNATHRBKMT2AMEN1
SCHEMBL7250811 0.81 LMNA (0.56) ALDH1A1LMNATHRBKMT2AMEN1
SCHEMBL20767099 0.81 LMNA (0.56) ALDH1A1LMNATHRBKMT2AMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106573015-B Enteric elastomer 麻省理工学院 2021-11-26 CN claimed
CN-106573015-B Enteric elastomer 麻省理工学院 2021-11-26 CN disclosed
CN-106714893-B Self-assembled residence device and related method 麻省理工学院 2021-01-01 CN disclosed
CN-111587088-A Stomach resident electronic device 麻省理工学院 2020-08-25 CN disclosed
EP-2900916-A1 TRIGGERABLE LOST CIRCULATION MATERIAL AND METHOD OF USE Halliburton Energy Services, Inc. (US) 2015-08-05 EP disclosed