SCHEMBL11599494

SCHEMBL11599494

CCCCOC(=O)CCC(O)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.50
ATM Q13315 2/20 0.46
TSHR P16473 2/20 0.46
CYP3A4 P08684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NAAA Q02083 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
DUSP3 P51452 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 1/20 0.45
HTR2C P28335 1/20 0.45
MAPT P10636 1/20 0.43
DNM1 Q05193 1/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL11598525 0.93 NAAA (0.56) DGKANAAAKDM4EDUSP3MEN1
SCHEMBL11599134 0.93 NAAA (0.56) DGKANAAAKDM4EDUSP3MEN1
SCHEMBL11599365 0.93 NAAA (0.56) DGKANAAAKDM4EDUSP3MEN1
SCHEMBL11599426 0.93 NAAA (0.56) DGKANAAAKDM4EDUSP3MEN1
SCHEMBL29290002 0.89 DGKA (0.50) DGKAATMTSHRCYP3A4TDP1
SCHEMBL17507920 0.89 DGKA (0.50) DGKAATMTSHRCYP3A4TDP1
SCHEMBL23983022 0.89 DGKA (0.53) DGKAATMTSHRCYP3A4TDP1
SCHEMBL11598513 0.89 L3MBTL1 (0.46) DGKAATMTSHRCYP3A4TDP1
SCHEMBL18968312 0.88 DGKA (0.59) DGKAATMTSHRCYP3A4TDP1
SCHEMBL18968382 0.88 DGKA (0.59) DGKAATMTSHRCYP3A4TDP1

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-4070500-A KETONE RESIN, EXTENDER MILLMASTER ONYX CORPORATION (US) 1978-01-24 US disclosed