SCHEMBL15216482

SCHEMBL15216482

CCCN1CCN(C(=O)c2ccc(-c3cc(Cl)c(CC4CCN(C5CCCCC5)C4=O)c(Cl)c3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
HRH3 Q9Y5N1 4/20 0.40
PDE5A O76074 1/20 0.40
PDE4A P27815 1/20 0.40
PDE1A P54750 1/20 0.40
PDE1B Q01064 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PDE7A Q13946 1/20 0.40
PDE1C Q14123 1/20 0.40
PDE3A Q14432 1/20 0.40
PDE7B Q9NP56 1/20 0.40
KCNA5 P22460 2/20 0.39
CHKA P35790 1/20 0.39
DRD3 P35462 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL2722062 0.93 SMN1; SMN2 (0.43) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL210732 0.92 HTT (0.46) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL210028 0.91 HSD11B1 (0.40) HSD11B1HRH3PDE5APDE4APDE1A
Hydrochloric Acid SCHEMBL209222 0.91 HTT (0.47) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL12576591 0.91 HSD11B1 (0.40) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL211080 0.91 PDE5A (0.48) HSD11B1HRH3PDE5APDE4APDE1A
Hydrochloric Acid SCHEMBL207291 0.90 PDE5A (0.47) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL209326 0.89 HSD11B1 (0.43) HSD11B1HRH3PDE5APDE4APDE1A
SCHEMBL208807 0.89 HSD11B1 (0.46) HSD11B1HRH3ALDH1A1KMT2A
SCHEMBL210606 0.89 HSD11B1 (0.46) HSD11B1HRH3ALDH1A1KMT2A

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
EP-2016047-B1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2013-08-28 EP disclosed