SCHEMBL4064157

SCHEMBL4064157

O=C(NC1CNC1)c1ccc(-c2cc(Cl)c(C(C3CCCCC3)C3CCNC3=O)c(Cl)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.39
MC5R P33032 2/20 0.37
MC4R P32245 1/20 0.37
MC3R P41968 1/20 0.37
MC1R Q01726 1/20 0.37
JAK2 O60674 1/20 0.37
RAB9A P51151 5/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
HDAC4 P56524 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL4063688 0.93 SMYD3 (0.41) CNR2RAB9APSEN1PSEN2APH1B
SCHEMBL209957 0.86 USP5 (0.40) MC5R
SCHEMBL209307 0.85 PDE4D (0.41)
SCHEMBL4064162 0.85 HTT (0.36) CNR2MC5RRAB9APSEN1PSEN2
SCHEMBL4063694 0.85 HTT (0.39) CNR2MC5RRAB9AKMT2ANPC1
SCHEMBL208481 0.83 SLC6A3 (0.41) MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL4062030 0.83 CNR2 (0.41) CNR2RAB9APSEN1PSEN2APH1B
SCHEMBL209052 0.82 HDAC4 (0.48) CNR2RAB9AHDAC4MEN1KMT2A
SCHEMBL210062 0.82 CA2 (0.40)
SCHEMBL208725 0.80 PDE5A (0.39) MEN1KMT2ASMN1; SMN2HPGD

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
EP-2016047-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-01-21 EP disclosed
WO-2007124337-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-01 WO disclosed