SCHEMBL8627145

SCHEMBL8627145

CC(N)C(Cc1ccc(Cl)cc1)c1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 3/20 0.54
SLC6A2 P23975 3/20 0.51
SLC6A3 Q01959 2/20 0.51
SLC6A4 P31645 2/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CYP2D6 P10635 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
MAOA P21397 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
CYP2A6 P11509 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL5585134 0.82 SLC6A2 (0.53) SLC6A2SLC6A3SLC6A4CNR1ALDH1A1
SCHEMBL13113800 0.79 CNR1 (0.52) SLC6A2SLC6A3SLC6A4CNR1CNR2
Hydrochloric Acid SCHEMBL3373474 0.78 CNR1 (0.51) SLC6A2SLC6A3SLC6A4CNR1CNR2
SCHEMBL3374595 0.78 SLC6A2 (0.45) ACP3SLC6A2SLC6A3SLC6A4CNR1
SCHEMBL3375743 0.76 IDO1 (0.48) SLC6A2SLC6A3SLC6A4ALDH1A1CYP2D6
SCHEMBL3374924 0.75 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4CNR1CNR2
SCHEMBL3374922 0.75 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4CNR1CNR2
SCHEMBL27614823 0.75 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4CNR1CNR2
SCHEMBL8621733 0.74 CYP1A2 (0.44) SLC6A2SLC6A3SLC6A4CYP1A2CYP2C19
SCHEMBL8625124 0.74 HTR2A (0.50) SLC6A2SLC6A3SLC6A4CNR1CNR2

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