SCHEMBL11297557

SCHEMBL11297557

CC1(C)OC(=O)CC1C=CCl

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.31

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
SCHEMBL3197862 0.78 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL9796770 0.77 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL10686103 0.73 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL9796917 0.73 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL10688299 0.73 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL11260756 0.72 ALDH1A1 (0.39) ALDH1A1LMNATSHR
SCHEMBL11013964 0.69
SCHEMBL11013965 0.69
SCHEMBL11261446 0.69 ALDH1A1 (0.34) ALDH1A1LMNA
SCHEMBL701301 0.68 ALDH1A1 (0.40) ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0042963-A1 Pesticidal compositions containing tetrahydrofuran-2-one derivatives, their preparation and their use BAYER AG (DE) 1982-01-06 EP disclosed
US-4288370-A Halogenovinyl-substituted tetra-hydrofuran-2-ones BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US disclosed
US-4225704-A Preparation of halogenovinyl-substituted tetra-hydrofuran-2-ones BAYER AKTIENGESELLSCHAFT (DE) 1980-09-30 US disclosed
US-4215050-A Preparation of halogenovinyl-γ-butyrolactones BAYER AKTIENGESELLSCHAFT (DE) 1980-07-29 US disclosed