SCHEMBL18285271

SCHEMBL18285271

CCCCCOOCCOC(=O)CCCCC

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.77
DNM1 Q05193 1/20 0.58
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
NAAA Q02083 1/20 0.53
PAM P19021 2/20 0.53
HTR2C P28335 1/20 0.51
TSHR P16473 1/20 0.50
MAPT P10636 1/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
EPHX2 P34913 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
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
Ethylene Glycol Dihexanoate SCHEMBL435208 0.89 DGKA (0.95) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL17812631 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL8161925 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL369211 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
Glycol Distearate SCHEMBL29407 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL3677993 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL3970181 0.87 DGKA (0.83) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL1197282 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL8154593 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL813087 0.87 DGKA (1.00) DGKADNM1PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3303436-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M Innovative Properties Company (US) 2018-04-11 EP disclosed
WO-2016196242-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-12-08 WO disclosed