SCHEMBL14067386

SCHEMBL14067386

CCN(CO)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.43
ADH1C P00326 3/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.38
PHGDH O43175 2/20 0.37
CYP2D6 P10635 3/20 0.35
CYP2C9 P11712 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
TMEM97 Q5BJF2 1/20 0.34
EBP Q15125 1/20 0.34

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
Methyl Alcohol SCHEMBL2132462 0.85 ADH1A (0.46) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL8159835 0.85 CYP2D6 (0.39) ADH1AADH1CALDH1A1PHGDHCYP2D6
SCHEMBL23073672 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL612572 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL28388990 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL613463 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL611858 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL356022 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
SCHEMBL150343 0.85 ADH1A (0.50) ADH1AADH1CMEN1KMT2AALDH1A1
Methyl Alcohol SCHEMBL2132451 0.82 ADH1A (0.43) ADH1AADH1CMEN1KMT2AALDH1A1

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
EP-1325910-B1 ALIPHATIC NITROGENOUS FIVE-MEMBERED RING COMPOUNDS MITSUBISHI TANABE PHARMA CORP (JP) 2008-09-17 EP disclosed