SCHEMBL11248974

SCHEMBL11248974

CC(CN)N(C)C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
TRPM8 Q7Z2W7 2/20 0.43
ADRA2C P18825 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
PGR P06401 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42
KCNH2 Q12809 1/20 0.42
HSD11B1 P28845 1/20 0.42
KMT2A Q03164 2/20 0.41
NOD2 Q9HC29 1/20 0.40
MEN1 O00255 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL24568139 0.84 NPY5R (0.50) TRPM8ALDH1A1HPGDPGRADRA2A
SCHEMBL28259164 0.81 ALDH1A1 (0.45) TRPM8ALDH1A1HPGDPGRADRA2A
SCHEMBL20029880 0.81 NOD2 (0.43) GAATRPM8ALDH1A1HPGDPGR
SCHEMBL14008052 0.81 NPY5R (0.52) ADRA2CHPGDADRA2AADRA2BHTR2A
SCHEMBL8615898 0.81 NPY5R (0.52) ADRA2CHPGDADRA2AADRA2BHTR2A
SCHEMBL14008053 0.81 NPY5R (0.52) ADRA2CHPGDADRA2AADRA2BHTR2A
SCHEMBL18320604 0.79 PGR (0.44) TRPM8ALDH1A1HPGDPGRADRA2A
SCHEMBL394512 0.79 HSD11B1 (0.53) TRPM8ALDH1A1HPGDPGRADRA2A
SCHEMBL3057264 0.78 ALPI (0.44) GAAALDH1A1HPGDKMT2AMEN1
SCHEMBL3644875 0.78 MEN1 (0.59) GAAALDH1A1KCNH2KMT2AMEN1

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-4341893-A HYPOTENSIVE AGENTS SYNTHELABO (FR) 1982-07-27 US disclosed