Etocarlide

Etocarlide

SCHEMBL7874639

CC(=O)Oc1ccccc1[PH](c1ccccc1)(c1ccccc1)c1ccccc1.CCOc1ccc(NC(=S)Nc2ccc(OCC)cc2)cc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
KMT2A Q03164 6/20 0.49
LMNA P02545 4/20 0.49
GAA P10253 4/20 0.49
MEN1 O00255 4/20 0.48
ALDH1A1 P00352 4/20 0.48
NTSR1 P30989 1/20 0.48
NPSR1 Q6W5P4 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ALOX12 P18054 1/20 0.47
CYP1A2 P05177 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPK1 P28482 3/20 0.46
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46

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
Etocarlide SCHEMBL7874714 0.87 MAPT (0.60) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7871254 0.86 MAPT (0.57) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL2857287 0.83 MAPT (0.73) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7877232 0.81 MAPT (0.59) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7874658 0.79 KMT2A (0.67) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7877162 0.78 MAPT (0.58) MAPTKMT2ALMNAGAAMEN1
SCHEMBL20416298 0.77 PTGS2 (0.53) MAPTLMNAGAAALDH1A1CYP1A2
Etocarlide SCHEMBL7872876 0.76 MAPT (0.71) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7871203 0.76 MAPT (0.71) MAPTKMT2ALMNAGAAMEN1
Etocarlide SCHEMBL7877205 0.76 MAPT (0.71) MAPTKMT2ALMNAGAAMEN1

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-6316575-B1 MELT TRANSESTERIFICATION OF DIOL COMPOUND AND CARBOANTE COMPOUND USING CATALYST COMPRISING A PHOSPHORUS-CONTAINING BASIC COMPOUND QUATERNARY PHOSPHONIUM SALT TO FORM POLYCARBONATE IDEMITSU KOSAN CO., LTD. (JP) 2001-11-13 US claimed