SCHEMBL3634708

SCHEMBL3634708

[C]1=CCc2ccccc2C1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.38
GAA P10253 2/20 0.37
CYP11B2 P19099 1/20 0.37
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 6/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33

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
SCHEMBL8418267 0.79 KDM1A (0.39) GAAMEN1KMT2ASLC6A2SLC6A4
SCHEMBL874497 0.76 HTR2A (0.34) CYP2D6HTR2AHTR2C
SCHEMBL4307808 0.76 HTR2A (0.34) HTR2AHTR2C
SCHEMBL4019122 0.75 KDM1A (0.42) CYP2D6SLC6A2SLC6A4SLC6A3HPGD
SCHEMBL3389204 0.74 HTR2A (0.35) HTR2AHTR2C
SCHEMBL4290508 0.72 HTR2A (0.35) PRCPHTR2AHTR2CHTR2B
SCHEMBL458123 0.72 HTR2A (0.34) HTR2AHTR2C
SCHEMBL6521360 0.72 HTR2A (0.35) PRCPHTR2AHTR2CHTR2B
SCHEMBL458495 0.72 HTR2A (0.35) PRCPHTR2AHTR2CHTR2B
SCHEMBL455932 0.72 HTR2A (0.34) HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150526-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE High Point Pharmaceuticals, LLC (US) 2010-02-10 EP disclosed
EP-1963343-A1 POLYPEPTIDE PROTRACTING TAGS Novo Nordisk A/S (DK) 2008-09-03 EP disclosed
WO-2008101914-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (GB) 2008-08-28 WO disclosed
WO-2007068718-A1 POLYPEPTIDE PROTRACTING TAGS NOVO NORDISK A/S (DK) 2007-06-21 WO disclosed
US-5561139-A IMMUNOSUPPRESSANTS; SIDE EFFECT REDUCTION ABBOTT LABORATORIES (US) 1996-10-01 US disclosed
US-5541189-A Substituted aliphatic amine-containing macrocyclic immunomodulators ABBOTT LABORATORIES (US) 1996-07-30 US disclosed
US-5530120-A ANALOGS OF ASCOMYCIN AND FK-506 AS IMMUNOSUPPRESSANTS AND-MODULATORS; SIDE EFFECT REDUCTION ABBOTT LABORATORIES (US) 1996-06-25 US disclosed
US-5457194-A Immunosuppressants ABBOTT LABORATORIES (US) 1995-10-10 US disclosed
WO-1994021253-A1 SUBSTITUTED ALIPHATIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1994-09-29 WO disclosed
WO-1994021634-A1 SUBSTITUTED ALICYCLIC-ALIPHATIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1994-09-29 WO disclosed
US-3997613-A PLASTICIZER REICHHOLD CHEMICALS, INC. (US) 1976-12-14 US disclosed