SCHEMBL9877667

SCHEMBL9877667

CN(C)C(=O)C(C)(C)n1ccc(-c2ccccc2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
F2RL3 Q96RI0 1/20 0.38
CNR2 P34972 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALPL P05186 1/20 0.37
TSPO P30536 1/20 0.36
DGAT2 Q96PD7 1/20 0.35
HSD11B1 P28845 1/20 0.35
CTSA P10619 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
NR4A2 P43354 1/20 0.34
GPBAR1 Q8TDU6 1/20 0.34
CNR1 P21554 1/20 0.34

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
SCHEMBL11621275 0.85 KDM4E (0.40) SCN9ANPC1HPGDRAB9AL3MBTL1
SCHEMBL11623976 0.84 MGLL (0.37) MEN1KMT2ANPC1HPGDRAB9A
SCHEMBL11620754 0.81 KMT2A (0.46) SCN9AMEN1KMT2ANPC1HPGD
SCHEMBL11623460 0.81 ALDH1A1 (0.40) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL11624495 0.80 KMT2A (0.39) SCN9AMEN1KMT2ACNR2NPC1
SCHEMBL11622693 0.77 GPBAR1 (0.40) MEN1KMT2ATSPODGAT2GPBAR1
SCHEMBL11624087 0.77 PDE4B (0.38) SCN9AMEN1KMT2ACNR2NPC1
SCHEMBL11622099 0.76 GPBAR1 (0.39) MEN1KMT2ANPC1HPGDRAB9A
SCHEMBL11620478 0.75 GPBAR1 (0.38) MEN1KMT2ACNR2TSPODGAT2
SCHEMBL11623925 0.73 SCN9A (0.41) SCN9AMEN1KMT2AALPLTSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4072498-A HERBICIDES THE UPJOHN COMPANY (US) 1978-02-07 US claimed
US-4988725-A Cardiovascular disorders, antiarrhythmia agents STERLING DRUG INC. (US) 1991-01-29 US disclosed
EP-0388654-A2 Azole-1-alkanamides as antiarrhythmic agents and preparation thereof STERLING DRUG INC. (US) 1990-09-26 EP disclosed
US-4072498-A HERBICIDES THE UPJOHN COMPANY (US) 1978-02-07 US disclosed