SCHEMBL11344752

SCHEMBL11344752

CCCCCCCCCC(=O)OCCCS(=O)(=O)O

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.67
DNM1 Q05193 1/20 0.56
PRSS1 P07477 1/20 0.53
PRSS2 P07478 1/20 0.53
PRSS3 P35030 1/20 0.53
NAAA Q02083 1/20 0.52
PAM P19021 2/20 0.51
HTR2C P28335 1/20 0.50
TSHR P16473 1/20 0.49
MAPT P10636 1/20 0.49
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TLR2 O60603 1/20 0.46
RAD52 P43351 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL11345638 1.00 DGKA (0.67) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL11329487 1.00 DGKA (0.67) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL11336270 1.00 DGKA (0.67) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL10946046 0.98 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL10945189 0.98 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL10948667 0.98 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL10946414 0.98 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL10267034 0.95 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL6128364 0.95 DGKA (0.65) DGKADNM1PRSS1PRSS2PRSS3
SCHEMBL16693727 0.93 DGKA (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4264576-A SULFOALKYL ALKANOATE SALT IN SILICONE RUBBER AS UTERINE INSERT ELI LILLY AND COMPANY (US) 1981-04-28 US disclosed