SCHEMBL9065964

SCHEMBL9065964

CC(=Cc1cccc(N)c1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.54
SLC9A3 P48764 1/20 0.54
SLC9A2 Q9UBY0 1/20 0.54
NPSR1 Q6W5P4 1/20 0.50
CYP19A1 P11511 3/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
AKR1C3 P42330 1/20 0.44
ALDH1A1 P00352 2/20 0.43
NOS1 P29475 1/20 0.42
NPC1 O15118 2/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.40
CYP3A4 P08684 1/20 0.38
CASP1 P29466 1/20 0.38
RECQL P46063 1/20 0.38
PBRM1 Q86U86 1/20 0.38
DDX3X O00571 1/20 0.38
GLO1 Q04760 1/20 0.37
MITF O75030 1/20 0.37

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
SCHEMBL9065961 1.00 SLC9A1 (0.54) SLC9A1SLC9A3SLC9A2NPSR1CYP19A1
SCHEMBL10349539 0.86 AKR1C3 (0.63) SLC9A1SLC9A3SLC9A2NPSR1CYP19A1
SCHEMBL30529806 0.86 AKR1C3 (0.63) SLC9A1SLC9A3SLC9A2NPSR1CYP19A1
SCHEMBL10349537 0.86 AKR1C3 (0.63) SLC9A1SLC9A3SLC9A2NPSR1CYP19A1
SCHEMBL3863126 0.82 SLC9A1 (0.54) SLC9A1SLC9A3SLC9A2MAOAMAOB
SCHEMBL8462385 0.82 SLC9A1 (0.54) SLC9A1SLC9A3SLC9A2MAOAMAOB
SCHEMBL13921161 0.81 CYP19A1 (0.50) SLC9A1SLC9A3SLC9A2NPSR1CYP19A1
SCHEMBL30834410 0.81 FBP1 (0.55) SLC9A1SLC9A3SLC9A2MAOBAKR1C3
SCHEMBL27971737 0.81 FBP1 (0.55) SLC9A1SLC9A3SLC9A2MAOBAKR1C3
SCHEMBL7871353 0.79 SLC9A1 (0.41) SLC9A1SLC9A3SLC9A2CYP19A1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571642-A LIGHT SENSITIVE ELEMENTS WITH CHEMICAL RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1996-11-05 US disclosed