SCHEMBL7412928

SCHEMBL7412928

CCCC(O)CC(=O)OCC(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.39
DUSP3 P51452 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 4/20 0.38
DGKA P23743 1/20 0.36
RECQL P46063 1/20 0.36
GPR84 Q9NQS5 4/20 0.36
CYP3A4 P08684 1/20 0.36
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL9742565 0.84 TSHR (0.41) MAPTKDM4EDUSP3MEN1KMT2A
SCHEMBL28611257 0.83 CYP19A1 (0.41) KDM4EKMT2ADGKAGPR84TDP1
SCHEMBL27906115 0.82 TSHR (0.39) MAPTKDM4EDUSP3MEN1KMT2A
SCHEMBL5477958 0.82 MGAM (0.46) KMT2ALMNATSHRGPR84CYP3A4
SCHEMBL873010 0.82 MGAM (0.46) KMT2ALMNATSHRGPR84CYP3A4
SCHEMBL5483236 0.82 MGAM (0.46) KMT2ALMNATSHRGPR84CYP3A4
SCHEMBL16341246 0.80 MAPT (0.53) MAPTKDM4EDUSP3MEN1KMT2A
SCHEMBL27576566 0.80 ALDH1A1 (0.40) MAPTKDM4EDUSP3LMNADGKA
SCHEMBL9174242 0.80 MGAM (0.44) KMT2ALMNATSHRGPR84CYP3A4
SCHEMBL29276396 0.80 PRKCA (0.44) KDM4EDUSP3MEN1KMT2ALMNA

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
WO-2000012466-A1 FORMAMIDE COMPOUNDS AS THERAPEUTIC AGENTS GLAXO GROUP LIMITED (GB) 2000-03-09 WO disclosed