SCHEMBL9505397

SCHEMBL9505397

CC1CCCC(c2cccc3ccccc23)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.47
DRD2 P14416 1/20 0.47
KDM1A O60341 1/20 0.46
MTNR1A P48039 2/20 0.43
SLC6A2 P23975 3/20 0.42
SLC6A3 Q01959 3/20 0.42
MTNR1B P49286 1/20 0.40
ACHE P22303 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SLC18A2 Q05940 1/20 0.37
PLA2G6 O60733 2/20 0.37
MAPK1 P28482 2/20 0.37
FAAH O00519 1/20 0.37
NPC1 O15118 1/20 0.37
GMNN O75496 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL3968194 0.84 SLC6A4 (0.56) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL14028169 0.81 SLC6A4 (0.47) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL497994 0.80 SLC6A4 (0.56) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL14028167 0.80 SLC6A4 (0.47) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL11364427 0.79 SLC6A4 (0.44) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL7650624 0.79 SLC6A4 (0.55) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL168782 0.78 SLC6A4 (0.54) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL30032791 0.78 SLC6A4 (0.54) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL4047901 0.78 SLC6A4 (0.54) SLC6A4DRD2KDM1AMTNR1ASLC6A2
SCHEMBL21568469 0.77 HTR2C (0.50) KDM1AMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0307866-B1 DICHROIC COLORING AGENTS FOR LIQUID CRYSTAL DISPLAYS MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-05-12 EP disclosed
US-4883611-A ANTHRAQUINONE COMPOUND CONTAINING DECAHYDRONAPHTHYL GROUP MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1989-11-28 US disclosed
EP-0307866-A2 Dichroic coloring agents for liquid crystal displays MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-03-22 EP disclosed