SCHEMBL28405271

SCHEMBL28405271

CCCCCCCCCCCCC(O)CS(=O)(=O)OC.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.46
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
PSMD14 O00487 2/20 0.40
PLA2G1B P04054 2/20 0.40
MMP2 P08253 2/20 0.40
ATG4B Q9Y4P1 2/20 0.40
HSP90AA1 P07900 1/20 0.40
RAD52 P43351 1/20 0.40
NFKB1 P19838 1/20 0.40
ZDHHC7 Q9NXF8 1/20 0.40
TP53 P04637 1/20 0.39
FAAH O00519 1/20 0.37

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
SCHEMBL29043313 1.00 GPR84 (0.46) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL23189496 0.85 GPR84 (0.41) GPR84FFAR1FFAR4ZDHHC7TP53
SCHEMBL15754291 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL15754772 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL11050219 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL11051640 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL15754869 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL15754650 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL11048094 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL15755071 0.79 GPR84 (0.50) GPR84FFAR1FFAR4PSMD14PLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112472617-A Self-thickening system of fatty acyl alkyl sulfonate, preparation method and application thereof 南京泛成生物科技有限公司 2021-03-12 CN claimed
CN-111093618-A Sulfate-free powder shampoo of natural origin OWA头发护理股份有限公司 2020-05-01 CN claimed
CN-110099659-B Composition having alpha-crystalline phase 莱雅公司 2022-04-26 CN disclosed
CN-108697589-B Composition with alpha crystalline phase 欧莱雅 2022-03-18 CN disclosed
CN-105705132-B Cosmetic composition containing at least one of sulfate and/or sulfonate surfactants and penicillanic acid 欧莱雅 2020-11-03 CN disclosed