SCHEMBL7107572

SCHEMBL7107572

CCOC(=O)OC1(OC(N)=O)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.43
ALDH1A1 P00352 3/20 0.41
SOAT1 P35610 1/20 0.39
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 2/20 0.31
MGAM O43451 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
POLB P06746 1/20 0.30
KDM4E B2RXH2 4/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7058356 0.91 ALDH1A1 (0.50) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL7932550 0.82 ALDH1A1 (0.55) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL9362849 0.76 ALDH1A1 (0.46) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL8654680 0.74 ALDH1A1 (0.44) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL8308690 0.73 ALDH1A1 (0.48) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL6898926 0.73 ALDH1A1 (0.48) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL7278609 0.73 ALDH1A1 (0.43) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL13104609 0.72 ALDH1A1 (0.46) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL10087948 0.72 ALDH1A1 (0.46) ALOX15ALDH1A1SOAT1LMNAHSD17B10
SCHEMBL7271059 0.71 ALDH1A1 (0.41) ALOX15ALDH1A1SOAT1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1046638-B1 Process for the preparation of aminoacid derivatives DEGUSSA (DE) 2003-10-01 EP disclosed
EP-1046638-A2 Process for the preparation of aminoacid derivatives Degussa-Hüls Aktiengesellschaft (DE) 2000-10-25 EP disclosed