SCHEMBL25510071

SCHEMBL25510071

CCC(N)Cc1ccc2ccccn12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
SLC6A4 P31645 2/20 0.34
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.31
CHEK1 O14757 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
LIMK1 P53667 1/20 0.31
MAPK14 Q16539 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
EPHX1 P07099 1/20 0.31

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
SCHEMBL25510171 0.88 SLC6A4 (0.35) HTR2ASLC6A4
SCHEMBL25515982 0.83 SLC6A4 (0.42) HTR2ASLC6A4
SCHEMBL25510072 0.78 SLC6A4 (0.37) SLC6A4
SCHEMBL7169853 0.76 ALDH1A1 (0.37) HTTATML3MBTL1KDM4ECHEK1
SCHEMBL25510070 0.74 SIGMAR1 (0.49) HTR2ASLC6A4MAPT
SCHEMBL25515345 0.73 TAAR1 (0.46) SLC6A4KDM4ECHEK1ALDH1A1MAPT
SCHEMBL25509953 0.73 TAAR1 (0.46) SLC6A4KDM4ECHEK1ALDH1A1MAPT
SCHEMBL6949233 0.72 KDM4E (0.37) L3MBTL1KDM4ECHEK1ALDH1A1MAPT
SCHEMBL7073068 0.70 TBXAS1 (0.44) HTTATML3MBTL1KDM4ECHEK1
SCHEMBL25516018 0.70 SLC6A2 (0.44) HTR2ASLC6A4

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-2023081306-A1 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR MENTAL ENHANCEMENT TACTOGEN INC (US) 2023-05-11 WO disclosed