SCHEMBL9856673

SCHEMBL9856673

CCCOC(=O)NCCOc1ccc(OC(C)CC)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KDM4E B2RXH2 1/20 0.45
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
MEN1 O00255 2/20 0.42
ACACB O00763 1/20 0.42
MAPK1 P28482 2/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9856365 0.91 L3MBTL1 (0.50) MAPTL3MBTL1ALDH1A1MTNR1AMTNR1B
SCHEMBL9856373 0.88 MTNR1A (0.50) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL10395541 0.86 ALDH1A1 (0.48) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856323 0.85 ALDH1A1 (0.47) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL10395749 0.85 MAPT (0.46) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856151 0.85 ACACB (0.45) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856638 0.85 ACACB (0.45) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856371 0.85 ACACB (0.45) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856297 0.83 ALDH1A1 (0.50) MAPTL3MBTL1ALDH1A1KDM4EMTNR1A
SCHEMBL9856468 0.83 MAPK1 (0.49) MAPTL3MBTL1ALDH1A1MTNR1AMTNR1B

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
US-5037991-A Insecticides SANDOZ LTD. (CH) 1991-08-06 US disclosed
US-4968829-A ANTHELMINTICS, PARASITICIDES, NEMATOCIDES SANDOZ LTD. (CH) 1990-11-06 US disclosed