SCHEMBL8716161

SCHEMBL8716161

CC(Cc1ccccc1Cl)(C[C@H](N)O)c1cccc(Cl)c1F

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
NR3C1 P04150 1/20 0.35
NR3C2 P08235 1/20 0.35
CFD P00746 1/20 0.34
HTT P42858 1/20 0.33
PNMT P11086 1/20 0.33
RIPK1 Q13546 3/20 0.32
PKM P14618 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CASR P41180 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
SCHEMBL8714126 0.91 KIF11 (0.33) SLC6A2SLC6A4SLC6A3NR3C1CFD
SCHEMBL8716208 0.90 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8713610 0.88 LMNA (0.43) NR3C1NR3C2CASR
SCHEMBL8713910 0.88 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8718570 0.84 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8714242 0.84 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8713790 0.81 NR3C1 (0.47) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8713660 0.80 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3HTTPNMT
SCHEMBL8716358 0.78 GRIN2B (0.46) SLC6A2SLC6A4SLC6A3NR3C1NR3C2
SCHEMBL8713286 0.78 TP53 (0.44) HTTPNMT

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
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed