SCHEMBL4005705

SCHEMBL4005705

O=C(NC1CCCN(S(=O)(=O)c2c(Cl)cccc2Cl)C1)C1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.67
RAB9A P51151 1/20 0.59
EPHX2 P34913 7/20 0.56
KMT2A Q03164 2/20 0.56
TSHR P16473 3/20 0.54
POLB P06746 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.53
MEN1 O00255 1/20 0.53

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
SCHEMBL4005700 1.00 HSD11B1 (0.67) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL612771 0.94 HSD11B1 (0.74) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL4447361 0.88 HSD11B1 (0.72) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL4010558 0.87 KMT2A (0.60) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL4010568 0.87 KMT2A (0.60) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL4145741 0.87 HSD11B1 (0.72) HSD11B1RAB9AEPHX2KMT2ATSHR
SCHEMBL4005031 0.86 HSD11B1 (0.70) HSD11B1RAB9AEPHX2KMT2AALDH1A1
SCHEMBL5950609 0.86 HSD11B1 (0.90) HSD11B1RAB9AEPHX2TSHR
SCHEMBL4010679 0.86 HSD11B1 (0.90) HSD11B1RAB9AEPHX2TSHR
SCHEMBL4007664 0.86 HSD11B1 (0.90) HSD11B1RAB9AEPHX2TSHR

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 claimed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP claimed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO claimed