SCHEMBL11244148

SCHEMBL11244148

CCCC(C)(c1cc(C2CCCCC2)c(O)c(C2CCCCC2)c1)c1cc(C2CCCCC2)c(O)c(C2CCCCC2)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.45
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR2 P34972 11/20 0.37
CYP2C9 P11712 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C19 P33261 2/20 0.34
NUDT1 P36639 1/20 0.34
BACE1 P56817 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL15803968 0.86 NUDT1 (0.42) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL11629807 0.85 CNR1 (0.38) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL9655970 0.80 KDM4E (0.42) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL200466 0.80 CYP2D6 (0.45) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL11631655 0.78 ESR1 (0.45) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL11629893 0.78 ALOX15 (0.42) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL16860599 0.78 CYP2D6 (0.43) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL10204058 0.78 KDM4E (0.39) CNR1KDM4EMEN1MAPTKMT2A
SCHEMBL21232295 0.76 ESR1 (0.43) CNR1CNR2NUDT1BACE1
SCHEMBL199835 0.76 CYP2C9 (0.46) CNR1KDM4EMEN1MAPTKMT2A

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-4345051-A Block copolymers of polyphenylene oxides and polyformals of sterically-hindered dihydric phenols GENERAL ELECTRIC COMPANY (US) 1982-08-17 US disclosed