SCHEMBL28601607

SCHEMBL28601607

CCCCCOCCCCC(C)=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.63
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 1/20 0.50
DGKA P23743 1/20 0.48
CES1 P23141 4/20 0.48
AKR1B1 P15121 1/20 0.46
FAAH O00519 1/20 0.45
PPARG P37231 5/20 0.44
PPARD Q03181 5/20 0.44
PPARA Q07869 5/20 0.44
HDAC11 Q96DB2 4/20 0.44
TSHR P16473 3/20 0.44
GPR84 Q9NQS5 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44

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
SCHEMBL17946903 0.98 CES2 (0.67) CES2MEN1KMT2ATHRBHTT
SCHEMBL31607440 0.98 CES2 (0.67) CES2MEN1KMT2ATHRBHTT
Water SCHEMBL5181823 0.96 CES2 (0.64) CES2MEN1KMT2ATHRBHTT
SCHEMBL18780724 0.96 CES2 (0.64) CES2MEN1KMT2ATHRBHTT
SCHEMBL20932438 0.95 CES2 (0.63) CES2MEN1KMT2ATHRBHTT
SCHEMBL20932201 0.95 CES2 (0.57) CES2MEN1KMT2ATHRBHTT
SCHEMBL2847742 0.93 CES2 (0.67) CES2MEN1KMT2ATHRBHTT
SCHEMBL16510217 0.93 CES2 (0.61) CES2MEN1KMT2ATHRBHTT
SCHEMBL704555 0.93 CES2 (0.61) CES2MEN1KMT2ATHRBHTT
SCHEMBL28347220 0.93 CES2 (0.67) CES2MEN1KMT2ATHRBHTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113905612-A Arthropod control composition 弗门尼舍有限公司 2022-01-07 CN claimed
CN-113873884-A Arthropod control composition 弗门尼舍有限公司 2021-12-31 CN claimed
CN-113163841-B Aerosol formulation 尼科创业贸易有限公司 2022-10-04 CN disclosed
CN-113905612-A Arthropod control composition 弗门尼舍有限公司 2022-01-07 CN disclosed
CN-113873884-A Arthropod control composition 弗门尼舍有限公司 2021-12-31 CN disclosed
CN-113163841-A Aerosol formulation 尼科创业贸易有限公司 2021-07-23 CN disclosed