SCHEMBL8796904

SCHEMBL8796904

CCCC(=O)C1=C(O)CC(C2CCCSC2=O)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.38
TSHR P16473 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
SCHEMBL8380177 0.79 TSHR (0.33) TSHR
SCHEMBL8547986 0.73 PDE4D (0.35) TSHR
SCHEMBL9719542 0.71 TSHR (0.34) TSHR
SCHEMBL9719563 0.69 TSHR (0.33) TSHR
SCHEMBL8956723 0.68 MAP1LC3B (0.33)
SCHEMBL28689396 0.68 TSHR (0.42) TSHR
SCHEMBL9718044 0.67 BUB1 (0.45) TSHR
SCHEMBL9718016 0.66 TSHR (0.35) TSHR
SCHEMBL28686165 0.64 TSHR (0.39) TSHR
SCHEMBL10503484 0.64 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0613618-B1 Method for safening herbicides in crops using substituted benzopyran and tetrahydronaphthalene compounds AMERICAN CYANAMID CO (US) 1997-04-16 EP claimed