Nitrogen

Nitrogen

SCHEMBL9845855

COc1ccccc1N1CCOCC1.N#N

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.67
DRD2 P14416 8/20 0.62
DRD3 P35462 6/20 0.62
HTR3E A5X5Y0 1/20 0.60
HTR3B O95264 1/20 0.60
ADRB1 P08588 1/20 0.60
CYP2C19 P33261 1/20 0.60
HTR3A P46098 1/20 0.60
HTR6 P50406 1/20 0.60
HTR3D Q70Z44 1/20 0.60
HTR3C Q8WXA8 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
MAPT P10636 4/20 0.58
LMNA P02545 1/20 0.58
DRD4 P21917 2/20 0.58
HRH2 P25021 1/20 0.58
HRH1 P35367 1/20 0.58
POLB P06746 3/20 0.54
ALDH1A1 P00352 3/20 0.54
GAA P10253 2/20 0.54

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
SCHEMBL3173622 0.96 AKR1C3 (0.70) AKR1C3DRD2DRD3HTR3EHTR3B
SCHEMBL12527300 0.95 AKR1C3 (0.68) AKR1C3DRD2DRD3HTR3EHTR3B
SCHEMBL27885780 0.81 AKR1C3 (0.54) AKR1C3DRD2DRD3HTR3EHTR3B
SCHEMBL1123579 0.80 USP2 (0.63) AKR1C3DRD2DRD3CYP2C19MAPT
SCHEMBL5256445 0.80 CTSL (0.55) AKR1C3DRD2DRD3MAPTDRD4
SCHEMBL27885724 0.80 AKR1C3 (0.52) AKR1C3DRD2DRD3HTR3EHTR3B
SCHEMBL3165674 0.80 DRD2 (0.72) DRD2DRD3HTR3EHTR3BADRB1
SCHEMBL30407688 0.80 DRD2 (0.72) DRD2DRD3HTR3EHTR3BADRB1
SCHEMBL31303216 0.79 ALDH1A1 (0.65) AKR1C3DRD2DRD3HTR3EHTR3B
Nitrogen SCHEMBL8776690 0.79 MAPT (0.60) CYP2C19MAPTLMNAPOLBALDH1A1

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-0415422-A2 Method for forming images FUJI PHOTO FILM CO., LTD. (JP) 1991-03-06 EP disclosed