SCHEMBL30867244

SCHEMBL30867244

CC(C)(C)OC(=O)N1CCCC1c1nnc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.60
LMNA P02545 6/20 0.60
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
MAPT P10636 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
HTT P42858 1/20 0.60
HSD11B1 P28845 1/20 0.59
ALDH1A1 P00352 7/20 0.58
POLB P06746 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
TP53 P04637 2/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.48
HCRTR1 O43613 1/20 0.47
HCRTR2 O43614 1/20 0.47

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
SCHEMBL30867229 0.97 TSHR (0.57) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL12098303 0.89 KMT2A (0.61) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL3296275 0.89 ALDH1A1 (0.57) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL13298120 0.89 ALDH1A1 (0.57) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL889018 0.89 ALDH1A1 (0.57) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL12098306 0.89 KMT2A (0.61) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL4955775 0.89 ALDH1A1 (0.60) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL4955786 0.89 ALDH1A1 (0.60) TSHRLMNAKMT2AMEN1MAPT
Water SCHEMBL27907680 0.88 ALDH1A1 (0.56) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL13114280 0.88 POLB (0.61) TSHRLMNAKMT2AMEN1MAPT

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
CN-113993850-B Modulators of integrated stress response pathways 埃沃特克国际有限责任公司 2024-03-29 CN disclosed