SCHEMBL10794838

SCHEMBL10794838

CCC(C)Oc1ccc(OCCOC(=O)N(CC)C(=O)C(=O)OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.39
MAPT P10636 3/20 0.37
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
KDM4E B2RXH2 2/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL10794833 0.88 ACACB (0.41) ACACBMAPTALDH1A1MEN1KMT2A
SCHEMBL10799514 0.85 KMT2A (0.38) ACACBMAPTLMNAHRH3KDM4E
SCHEMBL10797562 0.83 ACACB (0.40) ACACBMAPTMTNR1AMTNR1BHRH3
SCHEMBL10800490 0.83 PPARG (0.35) MAPTLMNATP53HRH3KDM4E
SCHEMBL9856531 0.81 KMT2A (0.45) ACACBMAPTHRH3KDM4EALDH1A1
SCHEMBL10795541 0.80 ACACB (0.38) ACACBMAPTMTNR1AMTNR1BLMNA
SCHEMBL10794809 0.79 KDM4E (0.40) ACACBMAPTMTNR1AMTNR1BHRH3
SCHEMBL9856371 0.75 ACACB (0.45) ACACBMAPTMTNR1AMTNR1BLMNA
SCHEMBL9856151 0.75 ACACB (0.45) ACACBMAPTMTNR1AMTNR1BLMNA
SCHEMBL9856638 0.75 ACACB (0.45) ACACBMAPTMTNR1AMTNR1BLMNA

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-4697033-A INSECTICIDES SANDOZ LTD. (CH) 1987-09-29 US claimed