SCHEMBL11637705

SCHEMBL11637705

OC(CNCc1ccccc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.60
LMNA P02545 2/20 0.54
BACE1 P56817 2/20 0.54
SLC6A11 P48066 1/20 0.54
ANPEP P15144 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SLC16A3 O15427 1/20 0.47
DNM1 Q05193 1/20 0.46

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
SCHEMBL7089480 0.86 BCHE (0.60) BCHELMNABACE1SLC6A11ANPEP
SCHEMBL7095555 0.86 BCHE (0.60) BCHELMNABACE1SLC6A11ANPEP
SCHEMBL18067594 0.85 DNM1 (0.53) BCHELMNAANPEPALDH1A1KDM4E
SCHEMBL14015728 0.82 BCHE (0.57) BCHELMNABACE1SLC6A11ALDH1A1
SCHEMBL7278068 0.81 LMNA (0.77) BCHELMNAKDM4EL3MBTL1MEN1
SCHEMBL2289990 0.81 LMNA (0.77) BCHELMNAKDM4EL3MBTL1MEN1
SCHEMBL1849603 0.81 LMNA (0.77) BCHELMNAKDM4EL3MBTL1MEN1
SCHEMBL4403903 0.79 ALDH1A1 (0.57) BCHELMNABACE1SLC6A11ANPEP
SCHEMBL11100850 0.79 BCHE (0.54) BCHELMNABACE1SLC6A11ANPEP
SCHEMBL31335199 0.79 ALDH1A1 (0.57) BCHELMNABACE1SLC6A11ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4113972-A ANTIDEPRESSANTS BEECHAM GROUP LIMITED (GB) 1978-09-12 US disclosed
US-4101676-A Diphenylpropylamines to treat depression BEECHAM GROUP LIMITED (GB) 1978-07-18 US disclosed