SCHEMBL18960979

SCHEMBL18960979

CCCCCCC(=O)ONC(=O)CCC=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.49
TRPV1 Q8NER1 1/20 0.46
POLB P06746 1/20 0.45
POLA1 P09884 1/20 0.45
DGKA P23743 2/20 0.44
TSHR P16473 2/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 3/20 0.42
MEN1 O00255 2/20 0.42
FAAH O00519 2/20 0.42
KMT2A Q03164 2/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
SOAT1 P35610 1/20 0.42
HSP90AA1 P07900 1/20 0.42
ALDH1A1 P00352 1/20 0.41
PAM P19021 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL13886959 0.98 CNR2 (0.47) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL24977871 0.86 ALDH1A1 (0.40) CNR2TRPV1POLBPOLA1TSHR
SCHEMBL7157837 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL9305133 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL30186702 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL8423003 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL8590568 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL8945838 0.86 HSP90AA1 (0.55) CNR2TRPV1POLBPOLA1DGKA
SCHEMBL17178187 0.85 ALDH1A1 (0.38) CNR2LMNAMEN1KMT2ACYP1A2
SCHEMBL15773178 0.85 ALDH1A1 (0.38) CNR2LMNAMEN1KMT2ACYP1A2

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-2017100714-A1 CELL PENETRATING CYANINE-COUPLED ANTIBODIES CITY OF HOPE (US) 2017-06-15 WO disclosed