SCHEMBL9645289

SCHEMBL9645289

O=CC=CCCCCCCCOc1ccc2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
TLR8 Q9NR97 2/20 0.36
CYSLTR2 Q9NS75 4/20 0.36
CYSLTR1 Q9Y271 4/20 0.36
LTB4R Q15722 3/20 0.36
HDAC1 Q13547 3/20 0.35
HDAC8 Q9BY41 3/20 0.35
HDAC6 Q9UBN7 3/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
PDE10A Q9Y233 1/20 0.35
GPBAR1 Q8TDU6 3/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34

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
SCHEMBL9645267 1.00 MEN1 (0.48) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9186725 0.86 MEN1 (0.52) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9184832 0.86 MEN1 (0.52) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9249618 0.79 MAPT (0.39) MEN1MAPTKMT2ACYSLTR2CYSLTR1
SCHEMBL9249624 0.79 MAPT (0.39) MEN1MAPTKMT2ACYSLTR2CYSLTR1
SCHEMBL9646718 0.79 MAPT (0.46) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9646706 0.79 MAPT (0.46) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9646688 0.79 MAPT (0.46) MEN1MAPTKMT2ATLR8CYSLTR2
SCHEMBL9187041 0.77 ADAMTS4 (0.38) MEN1MAPTKMT2ACYSLTR2CYSLTR1
SCHEMBL9187074 0.77 ADAMTS4 (0.38) MEN1MAPTKMT2ACYSLTR2CYSLTR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114940-A Insecticides or anthelmintics from fused ring heterocycles containing amides or thioamides ROUSSEL-UCLAF (FR) 1992-05-19 US disclosed
EP-0346107-A2 Arylfluoroalkenamides and their use as pesticides ROUSSEL UCLAF (FR) 1989-12-13 EP disclosed
EP-0317188-A2 Heteroaromatic enamide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1989-05-24 EP disclosed