SCHEMBL27639337

SCHEMBL27639337

COC(=O)C1(C)CCCCC1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 1/20 0.39
SOD1 P00441 1/20 0.37
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 3/20 0.34
ATM Q13315 1/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
POLA1 P09884 2/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
Hydrochloric Acid SCHEMBL5528439 0.98 MAPT (0.41) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL2201143 0.81 NR1H2 (0.34) MAPTCYP3A4SMN1; SMN2ALDH1A1
SCHEMBL27558383 0.81 GAA (0.32)
SCHEMBL19250331 0.80 CYP3A4 (0.32) NPSR1MEN1KMT2ACYP3A4MAPK1
SCHEMBL5491227 0.79 MAPT (0.42) MAPTNPSR1MEN1KMT2ACYP3A4
SCHEMBL18629017 0.79 MEN1 (0.46) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL3978516 0.79 MAPT (0.42) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL2124177 0.79 FFAR3 (0.36) NPSR1POLBTP53MAPK1SMN1; SMN2
SCHEMBL2124178 0.79 FFAR3 (0.36) NPSR1POLBTP53MAPK1SMN1; SMN2
SCHEMBL17784260 0.79 FFAR3 (0.36) NPSR1POLBTP53MAPK1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1742013-A Pyrazolopyrimidine compound and method for producing the same TANABE SEIYAKU CO (JP) 2006-03-01 CN disclosed