SCHEMBL29015392

SCHEMBL29015392

O=C(O)CCC1CCCNC1=O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.41
CCR2 P41597 6/20 0.37
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
ACE P12821 1/20 0.35
POLB P06746 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
SCHEMBL29015390 1.00 FOLH1 (0.51) FOLH1L3MBTL1CCR2TSHRKDM4E
SCHEMBL25313694 0.89 FOLH1 (0.46) FOLH1L3MBTL1CCR2TSHRKDM4E
SCHEMBL25313700 0.89 FOLH1 (0.46) FOLH1L3MBTL1CCR2TSHRKDM4E
SCHEMBL7351109 0.84 L3MBTL1 (0.40) FOLH1L3MBTL1CCR2HTT
SCHEMBL30140717 0.83 L3MBTL1 (0.39) FOLH1L3MBTL1CCR2HTT
SCHEMBL3649385 0.81 TSHR (0.45) L3MBTL1CCR2TSHRKDM4EHTT
SCHEMBL7277043 0.81 TSHR (0.45) L3MBTL1CCR2TSHRKDM4EHTT
SCHEMBL30403301 0.81 L3MBTL1 (0.38) FOLH1L3MBTL1CCR2HTT
SCHEMBL30402698 0.80 CCR2 (0.40) L3MBTL1CCR2TSHR
SCHEMBL30403414 0.79 L3MBTL1 (0.39) FOLH1L3MBTL1CCR2HTT

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-116096714-A Antiviral compounds for the treatment of coronavirus, picornavirus and norovirus infections 安力高医药股份有限公司 2023-05-09 CN disclosed