SCHEMBL8622962

SCHEMBL8622962

CC(N)C(Cc1ccc(Cl)cc1)c1ccc(-c2ccsc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
GRIA4 P48058 2/20 0.40
SLC6A4 P31645 1/20 0.39
FDFT1 P37268 2/20 0.39
CYP17A1 P05093 3/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
AKT1 P31749 1/20 0.37
ADRB2 P07550 1/20 0.37
NR1I2 O75469 1/20 0.36
HSD11B2 P80365 1/20 0.36
CNR1 P21554 3/20 0.36
CNR2 P34972 2/20 0.36
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
RET P07949 1/20 0.34

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
SCHEMBL8621289 0.87 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4FDFT1AKT1
SCHEMBL8619441 0.87 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4FDFT1AKT1
SCHEMBL8623635 0.85 PRMT6 (0.47) SLC6A2SLC6A3ADRB2CNR1
SCHEMBL3371502 0.85 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
SCHEMBL4691720 0.83 SLC6A3 (0.62) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
SCHEMBL8620804 0.82 FDFT1 (0.53) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
SCHEMBL8623834 0.82 FDFT1 (0.53) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
SCHEMBL8623070 0.82 FDFT1 (0.53) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
SCHEMBL8625643 0.82 FDFT1 (0.53) SLC6A2SLC6A3SLC6A4FDFT1ADRB2
Hydrochloric Acid SCHEMBL3371509 0.81 SLC6A2 (0.60) SLC6A2SLC6A3SLC6A4FDFT1ADRB2

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 6 patents. 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
EP-0611749-B1 Substituted amic acid derivatives useful for treatment of arteriosclerosis BANYU PHARMA CO LTD (JP) 1997-10-22 EP disclosed
US-5616803-A EXHIBIT SQUALENE SYNTHASE-INHIBITORY ACTIVITIES; USEFUL IN TREATMENT AND PROPHYLAXIS OF HYPERCHOLESTEREMIA, HYPERLIPEMIA AND ARTERIOSCLEROSIS BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-04-01 US disclosed
US-5606101-A INTERMEDIATES FOR SQUALENE SYNTHASE INHIBITORS BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-02-25 US disclosed
US-5488149-A SQUALENE SYNTHASE INHIBITORS AS ANTICHOLESTEROL OR ANTILIPEMIC AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-01-30 US disclosed
EP-0611749-A1 Substituted amic acid derivatives useful for treatment of arteriosclerosis BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-08-24 EP disclosed