SCHEMBL27488484

SCHEMBL27488484

CCCCCC1=C(OCCCC)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
HIF1A Q16665 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
ALOX5 P09917 18/20 0.36
MPEG1 Q2M385 4/20 0.36

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
SCHEMBL2137246 0.82 ALDH1A1 (0.45) ALDH1A1TDP1MAPTTHRBALOX5
SCHEMBL4247967 0.77 ALDH1A1 (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL16158023 0.77 GAA (0.39) ALDH1A1LMNAPOLBMAPT
SCHEMBL9004869 0.76 NAAA (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL27514767 0.75 GAA (0.38) LMNAMAPTTHRB
SCHEMBL18826201 0.75 LMNA (0.38) LMNAPOLBHIF1AMAPTTHRB
SCHEMBL3011707 0.74 LTA4H (0.41) ALDH1A1
SCHEMBL8084978 0.72 LMNA (0.41) LMNAPOLB
SCHEMBL7187409 0.72 SCD (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL114204 0.72 ALDH1A1 (0.41) ALDH1A1TDP1LMNAPOLBRECQL

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-1201027-A Telchnology for synthesizing 2-amyl-3-butoxy cyclopent-2-enone BEIJING CITY CHEMICAL INDUSTRY (CN) 1998-12-09 CN disclosed