SCHEMBL28709016

SCHEMBL28709016

CCCCCCC1(N)OC(=O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
RECQL P46063 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.41
MMP2 P08253 3/20 0.39
MMP9 P14780 3/20 0.39
MMP3 P08254 1/20 0.39
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39
POLB P06746 1/20 0.39
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
PTPN1 P18031 1/20 0.37
GAA P10253 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
SCHEMBL11617825 0.87 SMN1; SMN2 (0.45) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL28763781 0.80 MEN1 (0.52) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL547786 0.80 MEN1 (0.51) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL4028258 0.77 NPSR1 (0.49) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL4926594 0.77 NPSR1 (0.49) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL28582812 0.74 CYP2C9 (0.50) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL8031529 0.74 NPSR1 (0.51) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL31628334 0.74 NPSR1 (0.51) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL11126390 0.74 NPSR1 (0.46) NPSR1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL28552047 0.73 ATM (0.44) NPSR1CYP2C9CYP2C19MEN1KMT2A

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
CN-215655169-U Novel polymerization pipe for chinlon 6 slice production process 张家港市远程化纤有限公司 2022-01-28 CN disclosed
CN-215655169-U Novel polymerization pipe for chinlon 6 slice production process 张家港市远程化纤有限公司 2022-01-28 CN disclosed