SCHEMBL10656249

SCHEMBL10656249

CCOC(=O)C(CCC=O)NC(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.49
CYP26A1 O43174 1/20 0.48
BCHE P06276 2/20 0.47
ACHE P22303 2/20 0.47
SMN1; SMN2 Q16637 5/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 4/20 0.45
GAA P10253 2/20 0.45
P2RY12 Q9H244 2/20 0.45
NPC1 O15118 4/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL10654777 0.88 CYP26A1 (0.47) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL24924116 0.83 BCHE (0.51) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL3928918 0.83 HPGD (0.62) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL24950469 0.83 BCHE (0.51) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL29188972 0.83 CYP26A1 (0.54) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL7263139 0.83 HPGD (0.49) CTSLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL6313152 0.82 L3MBTL1 (0.61) CYP26A1BCHEACHEHPGDP2RY12
SCHEMBL3706987 0.82 L3MBTL1 (0.61) CYP26A1BCHEACHEHPGDP2RY12
SCHEMBL27673425 0.81 CYP26A1 (0.53) CTSLCYP26A1BCHEACHESMN1; SMN2
SCHEMBL26199837 0.81 CYP26A1 (0.53) CTSLCYP26A1BCHEACHESMN1; SMN2

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-4730006-A BACTERICIDES MERRELL DOW PHARMACEUTICALS INC. (US) 1988-03-08 US disclosed