SCHEMBL7294686

SCHEMBL7294686

CC(Cc1ccccc1N1CCN(C)CC1)C(=O)NCc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.52
MCHR1 Q99705 1/20 0.52
NPC1 O15118 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
TSHR P16473 1/20 0.45
MC4R P32245 7/20 0.45
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43

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
SCHEMBL7295239 0.88 NPBWR1 (0.48) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL7287748 0.81 NPBWR1 (0.52) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL7294695 0.79 NPBWR1 (0.47) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL14355804 0.78 BRD9 (0.51) L3MBTL1TSHRPOLBHTTKDM4E
SCHEMBL7286545 0.77 NPBWR1 (0.54) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL7295243 0.76 NPBWR1 (0.43) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL7295617 0.74 NPBWR1 (0.54) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL7295611 0.74 NPBWR1 (0.54) NPBWR1MCHR1NPC1L3MBTL1LMNA
SCHEMBL5160922 0.74 NPBWR1 (0.65) NPBWR1MCHR1LMNAGLATSHR
SCHEMBL7295032 0.73 NPBWR1 (0.53) NPBWR1MCHR1NPC1L3MBTL1LMNA

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-0810220-B1 Arylacrylamide derivatives as 5HT1 agonists or antagonists PFIZER (US) 2001-12-12 EP disclosed
US-6258953-B1 Arylacrylamide derivatives PFIZER INC. 2001-07-10 US disclosed
EP-0810220-A1 Arylacrylamide derivatives as 5HT1 agonists or antagonists PFIZER INC. (US) 1997-12-03 EP disclosed