SCHEMBL8698778

SCHEMBL8698778

CC(CC#N)OC(C)CC#N

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.38
TSHR P16473 3/20 0.38
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 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
SCHEMBL5166412 0.88
SCHEMBL1227367 0.79
SCHEMBL21863061 0.78
SCHEMBL23037491 0.77
SCHEMBL3972048 0.75
SCHEMBL28977788 0.73
SCHEMBL3765463 0.73
SCHEMBL13864133 0.73 TSHR (0.32) TSHR
SCHEMBL6599759 0.73 TSHR (0.32) TSHR
SCHEMBL1345692 0.72

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
JP-63010773-A None JP disclosed
EP-0314507-B1 Pastes for forming a luminescent layer or insulator layer of a dispersion type electroluminescence element and a dispersion type electroluminescence element NIPPON KASEI CHEM (JP) 1998-01-21 EP disclosed
EP-0314507-A2 Pastes for forming a luminescent layer or insulator layer of a dispersion type electroluminescence element and a dispersion type electroluminescence element NIPPON KASEI CHEMICAL CO., LTD. (JP) 1989-05-03 EP disclosed
JP-S6310773-A PRODUCTION OF 2-ALKENYL-2-OXAZOLINE SHOWA ROODEIA KAGAKU KK 1988-01-18 JP disclosed