SCHEMBL15445494

SCHEMBL15445494

CCC(COC(=O)CCCCCOC(=O)CCC(=O)O)(COC(=O)CCCCCOC(=O)CCC(=O)O)COC(=O)CCCCCOC(=O)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.47
PAM P19021 2/20 0.44
HTR2C P28335 1/20 0.43
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ALDH1A1 P00352 2/20 0.41
DNM1 Q05193 1/20 0.41
NAAA Q02083 1/20 0.40
NPC1 O15118 1/20 0.39
RAD52 P43351 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PPARG P37231 3/20 0.36
PPARD Q03181 3/20 0.36
PPARA Q07869 3/20 0.36
TSHR P16473 2/20 0.36
GPR84 Q9NQS5 2/20 0.36
HDAC11 Q96DB2 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
SLC22A6 Q4U2R8 1/20 0.36

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
SCHEMBL19343643 0.87 DGKA (0.55) DGKAPAMHTR2CPRSS1PRSS2
SCHEMBL15445495 0.85 DGKA (0.45) DGKAHTR2CPRSS1PRSS2PRSS3
SCHEMBL16248011 0.84 DGKA (0.47) DGKAPAMHTR2CPRSS1PRSS2
SCHEMBL13292134 0.84 PAM (0.44) DGKAPAMHTR2CALDH1A1NAAA
SCHEMBL26474164 0.82 DGKA (0.45) DGKAHTR2CPRSS1PRSS2PRSS3
SCHEMBL30477176 0.82 THRB (0.41) PAMALDH1A1TSHRMEN1KMT2A
SCHEMBL9462127 0.82 DGKA (0.60) DGKAPAMALDH1A1DNM1TSHR
SCHEMBL6906132 0.80 DGKA (0.69) DGKAPAMHTR2CPRSS1PRSS2
SCHEMBL17812663 0.80 DGKA (0.62) DGKAPAMALDH1A1DNM1TSHR
SCHEMBL15024334 0.80 DGKA (0.62) DGKAPAMALDH1A1DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295514-A1 Mesogen Compounds TRANSITIONS OPTICAL, LTD. (IE) 2023-09-21 US disclosed
US-9250356-B2 Photochromic polymers VIVIMED LABS EUROPE LTD (GB) 2016-02-02 US disclosed
US-20140027684-A1 PHOTOCHROMIC POLYMERS VIVIMED LABS EUROPE LTD (GB) 2014-01-30 US disclosed