SCHEMBL27932166

SCHEMBL27932166

CN1CCC(CCC(=O)CCC2CCN(C)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 3/20 0.50
GNAO1 P09471 3/20 0.50
GNAI1 P63096 3/20 0.50
NCF1 P14598 1/20 0.46
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
F2R P25116 1/20 0.43
HTR4 Q13639 1/20 0.43
ACHE P22303 3/20 0.42
HSD11B1 P28845 1/20 0.39
ALDH1A1 P00352 2/20 0.38
ATM Q13315 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
TP53 P04637 1/20 0.37
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL22859471 0.90 GNAI3 (0.50) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL12817476 0.89 GNAI3 (0.57) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL12617222 0.85 ITGB3 (0.52) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL13347933 0.85 GNAI3 (0.49) GNAI3GNAO1GNAI1NCF1ITGB3
Hydrochloric Acid SCHEMBL2423075 0.83 GNAI3 (0.51) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL6855190 0.83 NCF1 (0.48) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL2419318 0.83 GNAI3 (0.47) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL26723251 0.82 GNAI3 (0.46) GNAI3GNAO1GNAI1NCF1ITGB3
Hydrochloric Acid SCHEMBL30412623 0.82 GNAI3 (0.50) GNAI3GNAO1GNAI1NCF1ITGB3
SCHEMBL12254583 0.80 GNAI3 (0.45) GNAI3GNAO1GNAI1NCF1ITGB3

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
CN-101679410-B 2-[(2-substituted)-ind0lizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD 2013-11-27 CN disclosed