SCHEMBL30933796

SCHEMBL30933796

CCOc1ccc(Cl)cc1CNC1CC(N)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 2/20 0.50
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
HTR2C P28335 2/20 0.45
HTR2B P41595 2/20 0.45
HTR2A P28223 2/20 0.45
NPBWR1 P48145 1/20 0.45
MCHR1 Q99705 1/20 0.45
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM1A O60341 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC6A4 P31645 2/20 0.39
KCNH2 Q12809 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
Hydrochloric Acid SCHEMBL30933738 0.99 CYP1A2 (0.52) CYP1A2CYP2D6POLBATMHTR2C
SCHEMBL30933706 0.91 CYP1A2 (0.47) CYP1A2CYP2D6POLBATMHTR2C
Hydrochloric Acid SCHEMBL30933658 0.90 CYP1A2 (0.49) CYP1A2CYP2D6POLBATMHTR2C
SCHEMBL30933699 0.88 NPBWR1 (0.49) CYP1A2CYP2D6POLBATMHTR2C
Hydrochloric Acid SCHEMBL30933669 0.87 CYP1A2 (0.51) CYP1A2CYP2D6POLBATMHTR2C
SCHEMBL30933775 0.83 CYP1A2 (0.51) CYP1A2CYP2D6POLBATMHTR2C
Hydrochloric Acid SCHEMBL30933747 0.82 CYP1A2 (0.53) CYP1A2CYP2D6POLBATMHTR2C
SCHEMBL30933744 0.80 CYP1A2 (0.48) CYP1A2CYP2D6POLBATMHTR2C
SCHEMBL30933688 0.80 POLB (0.50) CYP1A2CYP2D6POLBATMNPBWR1
SCHEMBL30933787 0.79 ALDH1A1 (0.48) CYP1A2CYP2D6POLBATMNPBWR1

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