SCHEMBL11565494

SCHEMBL11565494

CCCCCN(CCCCC)C(=O)Oc1cc(C)cc(OCC(OC)OCCC)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.34
ELANE P08246 2/20 0.33
BLM P54132 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CNR1 P21554 4/20 0.33
CNR2 P34972 4/20 0.33
GRM5 P41594 1/20 0.32
F2 P00734 1/20 0.31

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
SCHEMBL11566247 0.89 CYP1A2 (0.33) PLA2G2ABLMTHRATHRBCNR1
SCHEMBL11566419 0.76 BACE1 (0.37) F2
SCHEMBL11564256 0.74 RAB9A (0.42)
SCHEMBL11566192 0.72 PLA2G2A (0.33) PLA2G2ABLMTHRATHRBCNR1
SCHEMBL11562985 0.70 MEN1 (0.42) THRATHRB
SCHEMBL11562108 0.70 CNR2 (0.47) PLA2G2ABLMCNR1CNR2
SCHEMBL11564934 0.69 MEN1 (0.46)
SCHEMBL14891873 0.68 LMNA (0.50)
SCHEMBL11564369 0.67 ALDH1A1 (0.35) GRM5
SCHEMBL11567376 0.65 MEN1 (0.42) THRATHRB

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
US-4163112-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1979-07-31 US disclosed