SCHEMBL28501262

SCHEMBL28501262

CCCCCCCCCCC(OC(C)=O)C(=O)OCCCC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
FAAH O00519 2/20 0.44
TSHR P16473 2/20 0.43
NAAA Q02083 1/20 0.43
ZDHHC7 Q9NXF8 1/20 0.42
PRKCA P17252 2/20 0.42
MAPT P10636 1/20 0.42
EPHX1 P07099 1/20 0.41
ATM Q13315 1/20 0.40
GPR84 Q9NQS5 3/20 0.39
DGKA P23743 1/20 0.39
FFAR1 O14842 1/20 0.39

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
SCHEMBL8376851 1.00 ALDH1A1 (0.52) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL15910275 1.00 ALDH1A1 (0.52) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL1681497 1.00 ALDH1A1 (0.52) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL6258273 0.97 TSHR (0.47) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL8376617 0.97 TSHR (0.47) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL8380705 0.97 TSHR (0.47) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL4334515 0.97 TSHR (0.47) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL10473435 0.97 TSHR (0.47) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL15903035 0.93 FAAH (0.44) ALDH1A1FAAHTSHRNAAAZDHHC7
SCHEMBL15903070 0.93 FAAH (0.44) ALDH1A1FAAHTSHRNAAAZDHHC7

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
CN-112088901-A Compositions and methods for directing oviposition by mosquitoes 劳伦森大学 2020-12-18 CN disclosed