SCHEMBL4010793

SCHEMBL4010793

Cc1c(Cl)cccc1S(=O)(=O)[C@@]1(NC(=O)c2ccccn2)CCCNC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.42
FPR2 P25090 1/20 0.42
GRM4 Q14833 6/20 0.40
MAPK1 P28482 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPKAPK2 P49137 1/20 0.37
LMNA P02545 2/20 0.36
PKM P14618 1/20 0.36
GAA P10253 1/20 0.36
PTGS2 P35354 1/20 0.36
PKLR P30613 1/20 0.35
SLC40A1 Q9NP59 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4009205 0.86 ITGB1 (0.38)
SCHEMBL4005617 0.86 ITGB1 (0.36) TP53
SCHEMBL3999745 0.86 FPR2 (0.39) GRM5FPR2ALDH1A1LMNA
SCHEMBL4010548 0.85 HSD11B1 (0.38)
SCHEMBL4010758 0.85 ALDH1A1 (0.37) MAPK1ALDH1A1KMT2A
SCHEMBL4004170 0.83 MAPT (0.39) SMN1; SMN2NPC1RAB9AALDH1A1LMNA
SCHEMBL4003450 0.83 HCRTR1 (0.36) RAB9AGAA
SCHEMBL4000706 0.82 KMT2A (0.38) NPC1RAB9AMAPKAPK2LMNAGAA
SCHEMBL4011653 0.82 HSD11B1 (0.38) LMNA
SCHEMBL4299977 0.81 KMT2A (0.39) ALDH1A1PTGS2KMT2A

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 6 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
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