SCHEMBL28861694

SCHEMBL28861694

CN(C)c1ccc(N)cc1CCC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ NR1H2 P55055 1/20 0.34
▸ APP P05067 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.32
▸ MTNR1A P48039 5/20 0.32
▸ MTNR1B P49286 5/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ STING1 Q86WV6 1/20 0.32
▸ ACHE P22303 1/20 0.31
▸ HTR6 P50406 1/20 0.31

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
SCHEMBL8413349 0.82 PRKCI (0.44) GAANR1H2APPHPGDCYP2C19
SCHEMBL23465360 0.81 NR1H4 (0.38) NR1H2APPHDAC8MTNR1AMTNR1B
SCHEMBL3694006 0.81 MTNR1A (0.39) NR1H2APPHDAC8MTNR1AMTNR1B
SCHEMBL18186254 0.80 HTR2C (0.38) GAAMAPTMAPK1NR1H2PRKCI
SCHEMBL7246662 0.80 GAA (0.36) GAAMAPTMAPK1NR1H2APP
SCHEMBL3630580 0.78 MTNR1A (0.42) NR1H2HDAC8MTNR1AMTNR1B
SCHEMBL6281581 0.77 KDM4A (0.41) —
SCHEMBL23465487 0.76 NR1H2 (0.42) GAANR1H2APPSTING1
SCHEMBL31726304 0.74 BACE1 (0.36) NR1H2APPHDAC8MTNR1AMTNR1B
SCHEMBL7322522 0.73 CYP4F2 (0.44) NR1H2

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-106827028-B Carbon tetrachloride dispensing feeding-distribution device and its method of work in a kind of processing underground water 徐州工程学院 2018-06-29 — — CN disclosed
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