SCHEMBL29655012

SCHEMBL29655012

CC(C)CC(Cl)CCC(C)Cl

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL22071627 0.88 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL22373330 0.85 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
SCHEMBL14955836 0.77 TSHR (0.41) ALDH1A1TSHRMAPK1
SCHEMBL1248824 0.77
SCHEMBL7863903 0.77
SCHEMBL27458283 0.74 TSHR (0.39) ALDH1A1TSHRMAPK1
SCHEMBL7872900 0.74
SCHEMBL27575222 0.72 DNM1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL19200599 0.72 LMNA (0.43)
SCHEMBL7740406 0.71 TSHR (0.33) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022095908-A1 HERBICIDE COMPOSITION AND USE THEREOF 沈阳中化农药化工研发有限公司 2022-05-12 WO claimed
CN-115413663-B Aqueous emulsion containing 2-methyl-4-chloroisooctyl ester, fluroxypyr-meptyl ester and clopyralid, and preparation method and application thereof 青岛润农化工有限公司 2024-08-06 CN disclosed
WO-2022095908-A1 HERBICIDE COMPOSITION AND USE THEREOF 沈阳中化农药化工研发有限公司 2022-05-12 WO disclosed