SCHEMBL6468322

SCHEMBL6468322

C[CH]C.[CH]1CC1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
MAOA P21397 10/20 0.37
MAOB P27338 10/20 0.37
KDM1A O60341 8/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
MAP1LC3B Q9GZQ8 1/20 0.36
CYP2C19 P33261 4/20 0.36
CYP2B6 P20813 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CYP2A6 P11509 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 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
SCHEMBL303054 0.89
SCHEMBL1779485 0.89
SCHEMBL2103232 0.89
SCHEMBL6519587 0.87 TSHR (0.42) TSHRMAOAMAOBKDM1AGAA
SCHEMBL4800650 0.87 TSHR (0.42) TSHRMAOAMAOBKDM1AGAA
SCHEMBL4297438 0.71 SLC18A3 (0.40) MAOAMAOBKDM1AGAAMAPT
SCHEMBL6523128 0.71 TSHR (0.34) TSHRMAOAMAOBKDM1AGAA
SCHEMBL779515 0.70 SLC18A3 (0.43) GAAMAPTCYP2C19CYP2D6
SCHEMBL1929909 0.69 SLC18A3 (0.41) TSHRMAOAMAOBKDM1AGAA
SCHEMBL8684748 0.69 ACHE (0.44) MAOAMAOBMAPTMAP1LC3BCYP2C19

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
US-6852804-B2 Star block copolymers and related synthetic methods THE UNIVERSITY OF AKRON (US) 2005-02-08 US disclosed
US-20040214951-A1 Star block copolymers and related synthetic methods AKRON, THE UNIVERSITY OF 2004-10-28 US disclosed