SCHEMBL9755826

SCHEMBL9755826

N#CCC(=O)CCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.52
LMNA P02545 4/20 0.46
TSHR P16473 3/20 0.43
NFKB1 P19838 2/20 0.43
PMP22 Q01453 1/20 0.43
FOLH1 Q04609 1/20 0.42
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
CAMK2A Q9UQM7 1/20 0.40
CYP1A2 P05177 2/20 0.39
MCL1 Q07820 1/20 0.39
GABRR3 A8MPY1 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
HDAC3 O15379 1/20 0.39
GABBR2 O75899 1/20 0.39
THRB P10828 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39

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
SCHEMBL9755815 0.85 EGLN1 (0.47) SLC22A6LMNATSHRNFKB1PMP22
SCHEMBL7998260 0.82 MCL1 (0.43) LMNATSHRNFKB1PMP22FOLH1
SCHEMBL8010699 0.82 MCL1 (0.43) LMNATSHRNFKB1PMP22FOLH1
SCHEMBL9732634 0.79 SLC22A6 (0.50) SLC22A6LMNATSHRNFKB1PMP22
SCHEMBL3899647 0.76
SCHEMBL503328 0.76 SLC22A6 (0.79) SLC22A6LMNATSHRNFKB1PMP22
Glutarate SCHEMBL31358954 0.76 SLC22A6 (0.92) SLC22A6LMNATSHRNFKB1PMP22
Glutarate SCHEMBL31358952 0.76 SLC22A6 (0.92) SLC22A6LMNATSHRNFKB1PMP22
Glutarate SCHEMBL5603986 0.76 SLC22A6 (0.92) SLC22A6LMNATSHRNFKB1PMP22
Glutarate SCHEMBL6368693 0.76 SLC22A6 (0.92) SLC22A6LMNATSHRNFKB1PMP22

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-1991005763-A1 DIPEPTIDE-ANALOG-BASED METALLOENDOPEPTIDASE INHIBITORS AND METHODS OF USING SAME THE SALK INSTITUTE BIOTECHNOLOGY/INDUSTRIAL ASSOCIATES, INC. (US) 1991-05-02 WO disclosed