SCHEMBL7210713

SCHEMBL7210713

CCCCN(CCCC)CCNC(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.67
DRD2 P14416 2/20 0.64
DRD4 P21917 2/20 0.64
DRD3 P35462 2/20 0.64
TDP1 Q9NUW8 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 2/20 0.54
SLC22A2 O15244 1/20 0.54
SLC22A1 O15245 1/20 0.54
ACHE P22303 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP2C19 P33261 1/20 0.54
POLB P06746 1/20 0.53
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
KMT2A Q03164 1/20 0.52
EPHX2 P34913 1/20 0.51
NPC1 O15118 1/20 0.51

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
SCHEMBL542239 0.85 TDP1 (0.74) NAAATDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL9364114 0.85 POLB (0.65) DRD2DRD4DRD3SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL7576777 0.84 TDP1 (0.72) NAAATDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL1002854 0.83 NAAA (0.86) NAAADRD2DRD4DRD3SMN1; SMN2
SCHEMBL9628332 0.83 NAAA (0.64) NAAADRD2DRD4DRD3TDP1
SCHEMBL10872544 0.82 TDP1 (0.60) NAAADRD2DRD4DRD3TDP1
SCHEMBL10872304 0.82 TDP1 (0.60) NAAADRD2DRD4DRD3TDP1
SCHEMBL7215489 0.82 THRA (0.63) DRD2DRD4DRD3LMNAALDH1A1
Hydrochloric Acid SCHEMBL9774095 0.82 NAAA (0.56) NAAADRD2DRD4DRD3TDP1
SCHEMBL1003680 0.82 NAAA (0.96) NAAADRD2DRD4DRD3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101663267-A Subsituted sulphonamides, process for their preparation, pharmaceutical composition comprising thereof and their use UNIMED PHARMA SPOL SRO 2010-03-03 CN claimed
CN-101663267-A Subsituted sulphonamides, process for their preparation, pharmaceutical composition comprising thereof and their use UNIMED PHARMA SPOL SRO 2010-03-03 CN disclosed
CN-1620421-A Substituted alkyl diammine compound EKOT RHEIN MEDICINE CO LTD (CH) 2005-05-25 CN disclosed
EP-1335899-A2 SUBSTITUTED ALKYLDIAMINES AS INHIBITORS OF PLASMEPSIN OR RELATED PROTEASES Actelion Pharmaceuticals Ltd. (CH) 2003-08-20 EP disclosed
WO-2002038534-A2 SUBSTITUTED ALKYLDIAMINES AS INHIBITORS OF PLASMEPSIN OR RELATED PROTEASES ACTELION PHARMACEUTICALS LTD (CH) 2002-05-16 WO disclosed