SCHEMBL30933652

SCHEMBL30933652

CCOc1ccc(OC(F)(F)F)cc1CNC1CCN(C)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 13/20 0.55
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
NPBWR1 P48145 1/20 0.44
MCHR1 Q99705 1/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
BACE1 P56817 2/20 0.43
KCNH2 Q12809 3/20 0.43
CYP2D6 P10635 1/20 0.43
SSTR5 P35346 1/20 0.42
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HRH1 P35367 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
SSTR4 P31391 2/20 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
SCHEMBL30933752 0.88 CARM1 (0.45) TACR1CARM1PRMT6BCHEACHE
Hydrochloric Acid SCHEMBL30933670 0.84 TACR1 (0.55) TACR1CARM1PRMT6NPBWR1MCHR1
SCHEMBL30933761 0.82 NPBWR1 (0.48) CARM1PRMT6NPBWR1MCHR1BCHE
SCHEMBL30933758 0.82 NPBWR1 (0.48) CARM1PRMT6NPBWR1MCHR1BCHE
SCHEMBL30933688 0.80 POLB (0.50) NPBWR1MCHR1BCHEACHEBACE1
SCHEMBL30933728 0.79 TACR1 (0.49) TACR1NPBWR1MCHR1KCNH2CYP2D6
SCHEMBL29227115 0.75 SLC6A5 (0.54) BCHEACHEBACE1HTR2A
SCHEMBL30873548 0.75 SLC6A5 (0.54) BCHEACHEBACE1HTR2A
SCHEMBL22361723 0.74 HTR2A (0.47) CARM1PRMT6MCHR1BCHEACHE
SCHEMBL31707512 0.74 HTR2A (0.47) CARM1PRMT6MCHR1BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO claimed
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed