SCHEMBL27969019

SCHEMBL27969019

CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC.[SnH2]

nearest known ligand 0.83

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.83
DNM1 Q05193 1/20 0.67
NAAA Q02083 1/20 0.63
PAM P19021 2/20 0.62
PRSS1 P07477 1/20 0.62
PRSS2 P07478 1/20 0.62
PRSS3 P35030 1/20 0.62
HTR2C P28335 1/20 0.59
TSHR P16473 1/20 0.58
MAPT P10636 1/20 0.58
LMNA P02545 4/20 0.56
ALDH1A1 P00352 1/20 0.56
KDM4E B2RXH2 1/20 0.55
DUSP3 P51452 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL28253498 1.00 DGKA (0.83) DGKADNM1NAAAPAMPRSS1
SCHEMBL8444189 1.00 DGKA (0.83) DGKADNM1NAAAPAMPRSS1
SCHEMBL4301736 1.00 DGKA (0.83) DGKADNM1NAAAPAMPRSS1
SCHEMBL27389117 0.98 DGKA (0.79) DGKADNM1NAAAPAMPRSS1
SCHEMBL542897 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1
SCHEMBL395831 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1
SCHEMBL7750961 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1
SCHEMBL8444191 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1
SCHEMBL2396240 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1
SCHEMBL4301741 0.98 DGKA (0.87) DGKADNM1NAAAPAMPRSS1

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
CN-104024300-B Sulfur-bearing is for optical material polymer composition and the optical material manufacture method of epoxy radicals (thioepoxy) compound KOC SOLUTION CO.,LTD. (KR) 2016-11-30 CN disclosed
CN-104024300-A POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL CONTAINING THIOEPOXY COMPOUND, AND PREPARATION METHOD OF OPTICAL MATERIAL KOC SOLUTION CO LTD 2014-09-03 CN disclosed