SCHEMBL8575130

SCHEMBL8575130

CCCCN(CCCC)C(=O)CCCCCc1cccc2c1C(C(=O)NCC(F)(F)F)c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
CYSLTR2 Q9NS75 2/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
FAAH O00519 1/20 0.32
MTTP P55157 1/20 0.32

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
SCHEMBL8673587 0.87 POLB (0.41) POLBCYSLTR2CYSLTR1MAPTKMT2A
SCHEMBL8574722 0.86 POLB (0.37) POLBCYSLTR2CYSLTR1MAPTKMT2A
SCHEMBL8577606 0.83 POLB (0.42) POLBMAPTKMT2A
SCHEMBL8571807 0.81 MTTP (0.53) MTTP
SCHEMBL8576794 0.80 MTTP (0.43) POLBMTTP
SCHEMBL17729935 0.80 POLB (0.38) POLB
SCHEMBL8573811 0.80 MTTP (0.54) MTTP
SCHEMBL8483124 0.80 POLB (0.45) POLB
SCHEMBL8576822 0.79 MTTP (0.48) MTTP
SCHEMBL8575135 0.78 BID (0.31) MAPT

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-5760246-A ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS BRISTOL-MYERS SQUIBB COMPANY 1998-06-02 US disclosed