SCHEMBL4551634

SCHEMBL4551634

CCN(CC)CCCNC(=O)CNC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.61
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TDP1 Q9NUW8 1/20 0.53
NAAA Q02083 1/20 0.52
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
KMT2A Q03164 3/20 0.52

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
SCHEMBL9628332 0.90 NAAA (0.64) GAAALDH1A1TDP1NAAADRD2
SCHEMBL14219224 0.84 NAAA (0.69) GAASMN1; SMN2NAAADRD2DRD4
SCHEMBL11854068 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11852545 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11850039 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11841161 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11854495 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11853375 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL11854927 0.81 NAAA (0.79) ALDH1A1SMN1; SMN2NAAAHDAC3HDAC4
SCHEMBL9545406 0.81 NAAA (0.58) GAAALDH1A1SMN1; SMN2NAAADRD2

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-2057116-A1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-05-13 EP disclosed
WO-2008050167-A1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2008-05-02 WO disclosed