SCHEMBL6473113

SCHEMBL6473113

CC1CCCC(O)=C(O)C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KMT2A Q03164 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
MEN1 O00255 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL8368969 0.78 CA1 (0.33) CA1CA2CA4
SCHEMBL18729654 0.72
SCHEMBL11519071 0.70
SCHEMBL14136797 0.70 MEN1 (0.31) ALDH1A1KMT2AMEN1
SCHEMBL9063173 0.70 MEN1 (0.31) ALDH1A1KMT2AMEN1
SCHEMBL3139956 0.69
SCHEMBL1402674 0.69
SCHEMBL3955362 0.68 CA1 (0.39) NOS3NOS1NOS2KDM4EALDH1A1
SCHEMBL3955331 0.68 CA1 (0.39) NOS3NOS1NOS2KDM4EALDH1A1
SCHEMBL3957270 0.68 CA1 (0.39) NOS3NOS1NOS2KDM4EALDH1A1

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
WO-2005050311-A1 STABILIZED HIGH-SPEED EMULSIONS AND PHOTOTHERMOGRAPHIC MATERIALS EASTMAN KODAK COMPANY (US) 2005-06-02 WO disclosed