SCHEMBL8619656

SCHEMBL8619656

CC(N)C(Cc1cccc2ccsc12)c1ccc(Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CYP19A1 P11511 2/20 0.36
ADRB2 P07550 1/20 0.36
DAO P14920 1/20 0.33
PNMT P11086 1/20 0.31
CYP2A6 P11509 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SCN5A Q14524 2/20 0.31
SCN10A Q9Y5Y9 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
FFAR2 O15552 3/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL8621733 0.79 CYP1A2 (0.44) SLC6A2SLC6A3ADRB2CYP2D6CYP2C19
SCHEMBL8620809 0.75 SLC6A2 (0.47) SLC6A2SLC6A3ADRB2PNMTMEN1
SCHEMBL8623862 0.74 GAA (0.40) SLC6A2SLC6A3HTR2AHTR2CMEN1
SCHEMBL10442294 0.74 GABRA1 (0.47) SLC6A2SLC6A3CYP19A1DAOCYP2A6
SCHEMBL8625832 0.69 CYP2A6 (0.43) SLC6A2SLC6A3ADRB2PNMTCYP2A6
SCHEMBL4691720 0.69 SLC6A3 (0.62) SLC6A2SLC6A3ADRB2PNMTMEN1
SCHEMBL13068399 0.69 HTT (0.47) SLC6A2SLC6A3ADRB2MEN1KMT2A
SCHEMBL8627137 0.68 SLC6A2 (0.52) SLC6A2SLC6A3ADRB2PNMTCYP2A6
SCHEMBL8625273 0.68 ADRB2 (0.43) SLC6A2SLC6A3CYP19A1ADRB2SCN5A
Hydrochloric Acid SCHEMBL3373847 0.68 HDAC8 (0.48) SLC6A2SLC6A3ADRB2MEN1KMT2A

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-5777150-A Substituted amic acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-07-07 US disclosed