SCHEMBL10873979

SCHEMBL10873979

CC(C)N(C(=O)C12C3C4C1C1C2C3C41C(=O)N(C(C)C)C(C)C)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM2 Q14416 1/20 0.33
GRM4 Q14833 1/20 0.33
SLC6A2 P23975 1/20 0.33

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
SCHEMBL10875323 0.87 SLC6A2 (0.30) SLC6A2
SCHEMBL9519463 0.81 TP53 (0.30)
SCHEMBL9518181 0.70 TP53 (0.32)
SCHEMBL10873297 0.66 SLC6A2 (0.30) SLC6A2
SCHEMBL10874046 0.66
SCHEMBL10871210 0.65 P2RX4 (0.33)
SCHEMBL8439081 0.65 P2RX4 (0.33)
SCHEMBL10160091 0.65 CHRNB2 (0.32)
SCHEMBL16064970 0.64 ALDH1A1 (0.44)
SCHEMBL31623253 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181926-A1 SUBSTITUTED CUBANES UNIVERSITY PATENTS, INC. (US) 1986-05-28 EP disclosed
WO-1985005357-A1 SUBSTITUTED CUBANES UNIVERSITY PATENTS, INC. (US) 1985-12-05 WO disclosed