SCHEMBL28684308

SCHEMBL28684308

O=C(CCCCCCCCCl)CCCCCCCCCl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 5/20 0.40
FAAH O00519 3/20 0.40
LMNA P02545 2/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
HAO1 Q9UJM8 1/20 0.34
CES2 O00748 3/20 0.33
CES1 P23141 3/20 0.33
GPR84 Q9NQS5 2/20 0.33
FFAR1 O14842 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
SCHEMBL28696440 1.00 MAPT (0.44) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL28690025 1.00 MAPT (0.44) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL10696543 1.00 MAPT (0.44) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL28696059 1.00 MAPT (0.44) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL6011904 0.97 MAPT (0.40) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL11139617 0.94 MAPT (0.41) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL6011836 0.94 MAPT (0.39) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL28519995 0.88 FAAH (0.52) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL11141201 0.88 FAAH (0.52) MAPTKMT2ATSHRFAAHLMNA
SCHEMBL9223607 0.87 MAPT (0.37) MAPTKMT2ATSHRFAAHLMNA

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-114058173-A Process and composition for producing flexible polyurethane foams 赢创运营有限公司 2022-02-18 CN disclosed