SCHEMBL4307015

SCHEMBL4307015

O=C(NC1CCCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)C1)C1CCCCC1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.74
KMT2A Q03164 3/20 0.61
NPC1 O15118 1/20 0.61
ATM Q13315 1/20 0.61
TSHR P16473 1/20 0.60
MEN1 O00255 1/20 0.58
HSD11B1 P28845 1/20 0.58
EPHX2 P34913 10/20 0.57
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56

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
SCHEMBL4307011 1.00 RAB9A (0.74) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4151467 0.91 RAB9A (0.70) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4005538 0.91 RAB9A (0.70) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4005534 0.91 RAB9A (0.70) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4006595 0.88 KMT2A (0.68) RAB9AKMT2ATSHRMEN1HSD11B1
SCHEMBL4006602 0.88 KMT2A (0.68) RAB9AKMT2ATSHRMEN1HSD11B1
SCHEMBL5950721 0.86 RAB9A (0.63) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4009266 0.86 RAB9A (0.63) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL4009269 0.86 RAB9A (0.63) RAB9AKMT2ANPC1ATMTSHR
SCHEMBL613408 0.85 RAB9A (0.77) RAB9AKMT2ANPC1ATMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO disclosed