SCHEMBL6979080

SCHEMBL6979080

[CH2]CC(N)N(C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.43
SLC6A4 P31645 6/20 0.43
HTR2A P28223 1/20 0.39
HRH1 P35367 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
AOC3 Q16853 3/20 0.34
TAAR1 Q96RJ0 2/20 0.34
MAOA P21397 1/20 0.34
SLC6A3 Q01959 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
CYP2A6 P11509 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34

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
SCHEMBL3205909 0.81 SLC6A2 (0.44) SLC6A2SLC6A4HTR2AHRH1TDP1
Hydrochloric Acid SCHEMBL11154625 0.76 SLC6A2 (0.50) SLC6A2SLC6A4HTR2AAOC3TAAR1
SCHEMBL11358492 0.73 SLC6A2 (0.44) SLC6A2SLC6A4MEN1HTTKMT2A
SCHEMBL7641118 0.72 CSNK1E (0.46) SLC6A2SLC6A4HTR2A
SCHEMBL6395425 0.71 SLC6A2 (0.52) SLC6A2SLC6A4MEN1HTTKMT2A
SCHEMBL27944699 0.70 SLC6A2 (0.40) SLC6A2SLC6A4HTR2AHRH1TDP1
SCHEMBL6699280 0.70 SLC6A2 (0.42) SLC6A2SLC6A4MEN1HTTKMT2A
SCHEMBL17468738 0.70 SLC6A2 (0.50) SLC6A2SLC6A4HTR2AHRH1TDP1
SCHEMBL10349465 0.68 SLC6A2 (0.53) SLC6A2SLC6A4HTR2AMEN1HTT
SCHEMBL94821 0.67 MEN1 (0.44) SLC6A2SLC6A4HTR2AHRH1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218343-A4 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2003-06-18 EP claimed
EP-1218343-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-07-03 EP claimed
WO-2001025203-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-04-12 WO claimed
CN-103709347-B A kind of preparation method through amido organosilicon modification laccol photocuring film FUJIAN NORMAL UNIVERSITY (CN) 2016-05-04 CN disclosed
EP-1218343-A4 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2003-06-18 EP disclosed
EP-1218343-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-07-03 EP disclosed
WO-2001025203-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-04-12 WO disclosed