SCHEMBL8082790

SCHEMBL8082790

N#CN(C(N)=NN=[N+]=[N-])c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL2420665 0.76 POLB (0.36) POLBALDH1A1
SCHEMBL6137753 0.71 CA2 (0.34) POLBALDH1A1
SCHEMBL7426969 0.70 ALDH1A1 (0.54) POLBALDH1A1
SCHEMBL27328134 0.70 NPSR1 (0.41) POLBALDH1A1
SCHEMBL4259665 0.70 KMT2A (0.40) POLBALDH1A1
SCHEMBL8082788 0.69
SCHEMBL437417 0.62 NPSR1 (0.41) ALDH1A1
SCHEMBL11682975 0.61 SMN1; SMN2 (0.46) ALDH1A1
SCHEMBL10661170 0.61 POLB (0.52) POLBALDH1A1
SCHEMBL28249141 0.61 ALDH1A1 (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792291-B1 PROTEIN AFFECTING KATP CHANNELS UPJOHN CO (US) 2000-09-20 EP disclosed
US-5925742-A GLYCOPROTEIN OF 54,000 TO 60,000 DALTONS FROM RAT CELLS AND CAPABLE OF BINDING N-(3-AZIDO-5-IODOPHENYL)-N'-CYANO-N''-(1,1-DIMETHYLPROPYL)-GUANIDINE; MODULATORS OF ADENOSINE TRIPHOSPHATE SENSITIVE POTASSIUM CHANNELS PHARMACIA & UPJOHN COMPANY (US) 1999-07-20 US disclosed
US-5856449-A GLYCOPROTEIN PHARMACIA & UPJOHN COMPANY (US) 1999-01-05 US disclosed
EP-0792291-A1 PROTEIN AFFECTING KATP CHANNELS PHARMACIA & UPJOHN COMPANY (US) 1997-09-03 EP disclosed
US-5525742-A IDENTIFICATION OF BIOCHEMICAL COMPONENTS FORMING ATP-SENSITIVE POTASSIUM CHANNELS IN SMOOTH MUSCLE CELLS THE UPJOHN COMPANY (US) 1996-06-11 US disclosed
US-5525742-A IDENTIFICATION OF BIOCHEMICAL COMPONENTS FORMING ATP-SENSITIVE POTASSIUM CHANNELS IN SMOOTH MUSCLE CELLS THE UPJOHN COMPANY (US) 1996-06-11 US disclosed
WO-1996016088-A1 PROTEIN AFFECTING KATP CHANNELS PHARMACIA & UPJOHN COMPANY (US) 1996-05-30 WO disclosed