Etocarlide

Etocarlide

SCHEMBL7873029

CCOc1ccc(NC(=S)Nc2ccc(OCC)cc2)cc1.c1ccc([PH](c2ccccc2)(c2ccccc2)c2ccccc2-c2cccc3ccccc23)cc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.62
MAPT P10636 8/20 0.52
MEN1 O00255 3/20 0.49
LMNA P02545 6/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 2/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
ALOX12 P18054 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPK1 P28482 1/20 0.44
NTSR1 P30989 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 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
Etocarlide SCHEMBL7874658 0.91 KMT2A (0.67) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7873047 0.84 KMT2A (0.73) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL2857287 0.82 MAPT (0.73) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7877232 0.80 MAPT (0.59) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7874714 0.79 MAPT (0.60) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7871254 0.78 MAPT (0.57) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7874639 0.76 MAPT (0.53) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7871203 0.76 MAPT (0.71) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7872876 0.76 MAPT (0.71) KMT2AMAPTMEN1LMNAALDH1A1
Etocarlide SCHEMBL7877205 0.76 MAPT (0.71) KMT2AMAPTMEN1LMNAALDH1A1

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