SCHEMBL30933719

SCHEMBL30933719

COCCOc1ccc(Cl)cc1CNC1CCC(N)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.45
HTR2B P41595 1/20 0.45
MAPT P10636 2/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TACR1 P25103 1/20 0.39
THRB P10828 1/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HTT P42858 3/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SGMS2 Q8NHU3 1/20 0.37
NPBWR1 P48145 1/20 0.37
MCHR1 Q99705 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP1A2 P05177 1/20 0.36

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
Hydrochloric Acid SCHEMBL30933663 0.99 HTR2C (0.46) HTR2CHTR2BMAPTPKML3MBTL1
SCHEMBL30933699 0.86 NPBWR1 (0.49) HTR2CHTR2BMAPTPKML3MBTL1
Hydrochloric Acid SCHEMBL30933669 0.85 CYP1A2 (0.51) HTR2CHTR2BMAPTPKML3MBTL1
SCHEMBL30933655 0.85 HTR2C (0.41) HTR2CHTR2BMAPTPKML3MBTL1
Hydrochloric Acid SCHEMBL30933750 0.80 TACR1 (0.44) HTR2CHTR2BTACR1NPBWR1MCHR1
SCHEMBL30933701 0.80 MAPK8 (0.44) HTR2CHTR2BMAPTTHRBKDM4E
SCHEMBL30933706 0.80 CYP1A2 (0.47) HTR2CHTR2BMAPTPKML3MBTL1
Hydrochloric Acid SCHEMBL30933658 0.79 CYP1A2 (0.49) HTR2CHTR2BMAPTPKML3MBTL1
Hydrochloric Acid SCHEMBL30933865 0.75 HTR2C (0.46) HTR2CHTR2BMAPTPKML3MBTL1
SCHEMBL15012409 0.75 MEN1 (0.50) MAPTL3MBTL1KDM4EALDH1A1MEN1

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