SCHEMBL28429153

SCHEMBL28429153

CCCCCC(=O)OCCOOCCCC

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.77
DNM1 Q05193 1/20 0.58
PAM P19021 2/20 0.53
TSHR P16473 1/20 0.50
MAPT P10636 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
LMNA P02545 4/20 0.49
ALDH1A1 P00352 1/20 0.49
NAAA Q02083 1/20 0.48
KDM4E B2RXH2 1/20 0.47
DUSP3 P51452 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HTR2C P28335 1/20 0.47
MGLL Q99685 1/20 0.46

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
SCHEMBL18285271 0.96 DGKA (0.77) DGKADNM1PAMTSHRMAPT
SCHEMBL29190314 0.90 DGKA (0.73) DGKADNM1PAMTSHRMAPT
Ethylene Glycol Dihexanoate SCHEMBL435208 0.89 DGKA (0.95) DGKADNM1PAMTSHRMAPT
SCHEMBL8667918 0.88 DGKA (0.64) DGKADNM1PAMTSHRMAPT
Glycol Distearate SCHEMBL29407 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT
SCHEMBL8154593 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT
SCHEMBL17812631 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT
SCHEMBL3677993 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT
SCHEMBL813087 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT
SCHEMBL1197282 0.87 DGKA (1.00) DGKADNM1PAMTSHRMAPT

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-111386098-A Delivery system for peroxide compounds and uses thereof 阿科玛股份有限公司 2020-07-07 CN disclosed