SCHEMBL19977026

SCHEMBL19977026

C=C(NCC)NC1Cc2ccccc2C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
MTNR1A P48039 4/20 0.45
MTNR1B P49286 4/20 0.45
MAPT P10636 1/20 0.44
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
GRM7 Q14831 4/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PRMT5 O14744 1/20 0.39

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
SCHEMBL12719286 0.80 MTNR1A (0.47) IDO1HRH3MTNR1AMTNR1BMAPT
SCHEMBL173810 0.79 IDO1 (0.56) IDO1HRH3MTNR1AMTNR1BMAPT
SCHEMBL173705 0.79 MTNR1A (0.53) IDO1HRH3MTNR1AMTNR1BMAPT
SCHEMBL22050527 0.75 MAOA (0.39) IDO1HRH3MTNR1AMTNR1BMAOA
SCHEMBL12656187 0.72 IDO1 (0.50) IDO1HRH3MTNR1AMTNR1BMAPT
SCHEMBL6359193 0.71 MTNR1A (0.79) HRH3MTNR1AMTNR1BMAPTGRM7
SCHEMBL4859978 0.71 GRIN2B (0.55) IDO1HRH3MTNR1AMTNR1BMAOA
Hydrochloric Acid SCHEMBL1026811 0.70 GRIN2B (0.53) IDO1HRH3MTNR1AMTNR1BMAOA
SCHEMBL13052260 0.69 IDO1 (0.51) IDO1HRH3MTNR1AMTNR1BMAPT
SCHEMBL30595323 0.68 MTNR1A (0.77) IDO1HRH3MTNR1AMTNR1BMAPT

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
US-9918473-B2 Use of aryl carbamates in agriculture and other plant-related areas North Carolian State University (US) 2018-03-20 US disclosed