SCHEMBL28843604

SCHEMBL28843604

CCCCCCc1cc[nH]c1CCCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.49
LIPG Q9Y5X9 1/20 0.43
TYR P14679 2/20 0.42
TP53 P04637 2/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL28171089 1.00 GPR84 (0.49) GPR84LIPGTYRTP53CYP3A4
SCHEMBL9784830 1.00 GPR84 (0.49) GPR84LIPGTYRTP53CYP3A4
SCHEMBL29405184 1.00 GPR84 (0.49) GPR84LIPGTYRTP53CYP3A4
Bromide SCHEMBL31310734 0.98 GPR84 (0.47) GPR84LIPGTYRTP53CYP3A4
SCHEMBL82799 0.98 GPR84 (0.46) GPR84LIPGTYRTP53CYP3A4
SCHEMBL3124388 0.92 GPR84 (0.39) GPR84LIPGTYRTP53CYP3A4
SCHEMBL28253637 0.90 GPR84 (0.47) GPR84LIPGTYRTP53CYP3A4
SCHEMBL7628671 0.87 GPR84 (0.45) GPR84LIPGTYRTP53CYP3A4
SCHEMBL9340462 0.85 GPR84 (0.42) GPR84LIPGTYRTP53CYP3A4
SCHEMBL15537389 0.82 GPR84 (0.42) GPR84TYRCYP3A4BIDMCL1

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
CN-104073910-B Application of the ionic liquid in polyethylene terephthalate composite fibre 浙江佳华精化股份有限公司 2017-06-20 CN claimed
CN-104073900-B Application of ionic liquid to polyurethane complex fiber 杭州师范大学 2017-05-10 CN claimed
CN-104073900-B Application of ionic liquid to polyurethane complex fiber 杭州师范大学 2017-05-10 CN disclosed