SCHEMBL8540547

SCHEMBL8540547

[c]1nc(N2CCCC2)ccc1N1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 5/20 0.41
MAPK1 P28482 4/20 0.41
MAPT P10636 5/20 0.36
HTT P42858 2/20 0.36
UBE2T Q9NPD8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
LMNA P02545 1/20 0.35
ALOX12 P18054 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35
CHKA P35790 1/20 0.34
CNR2 P34972 3/20 0.33
MAP4K4 O95819 1/20 0.33
PARP1 P09874 1/20 0.33
CASP1 P29466 2/20 0.32
CASP4 P49662 1/20 0.32
CASP5 P51878 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL18668207 0.78 CYP1A2 (0.48) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL3598725 0.71 MAPT (0.41) CYP1A2ALDH1A1MAPK1MAPTUBE2T
SCHEMBL14503215 0.67 CYP1A2 (0.75) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL1581515 0.67 CYP1A2 (0.37) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL1526838 0.67 CHKA (0.39) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL558464 0.67 CHKA (0.39) CYP1A2ALDH1A1MAPK1MAPTTDP1
SCHEMBL918905 0.67 CHKA (0.39) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL185803 0.65 HPGD (0.39) CYP1A2ALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL1852700 0.65 CHKA (0.38) CYP1A2ALDH1A1MAPK1MAPTHTT
SCHEMBL10435635 0.65 ALDH1A1 (0.37) ALDH1A1MAPK1HTTSMN1; SMN2TDP1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580633-B1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA (IT) 1998-06-17 EP claimed
US-5607930-A 1,4-disubstituted piperazines useful in the therapy of the asthma and of the inflammation of the respiratory tract BOEHRINGER MANNHEIM ITALIA, S.P.A. (IT) 1997-03-04 US claimed
US-5453423-A Heterocyclic amines useful in the therapy of asthma and imflammation of the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1995-09-26 US claimed
WO-1994007856-A1 1,4-DISUBSTITUTED PIPERAZINES USEFUL IN THE THERAPY OF THE ASTHMA AND OF THE INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1994-04-14 WO claimed
EP-0589985-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1994-04-06 EP claimed
WO-1993011134-A1 [3H,7H]THIAZOLE[3,4-a]PYRIDINES HAVING ANTIASTHMATIC AND ANTIINFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-06-10 WO claimed
WO-1993000342-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-01-07 WO claimed
EP-0519449-A1 2-Amino-4-aryl thiazoles with antiasthmatic and antiinflammatory activities on the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-12-23 EP claimed
WO-1992018478-A1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-10-29 WO claimed
EP-0580633-B1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA (IT) 1998-06-17 EP disclosed
US-5607930-A 1,4-disubstituted piperazines useful in the therapy of the asthma and of the inflammation of the respiratory tract BOEHRINGER MANNHEIM ITALIA, S.P.A. (IT) 1997-03-04 US disclosed
US-5453423-A Heterocyclic amines useful in the therapy of asthma and imflammation of the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1995-09-26 US disclosed
EP-0662957-A1 1,4-DISUBSTITUTED PIPERAZINES USEFUL IN THE THERAPY OF THE ASTHMA AND OF THE INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1995-07-19 EP disclosed
EP-0536169-B1 [3H,7H]THIAZOLO [3,4-a]PYRIDINES WITH ANTIASTHMATIC AND ANTIINFLAMMATORY ACTIONS ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA (IT) 1995-04-05 EP disclosed
WO-1993011134-A1 [3H,7H]THIAZOLE[3,4-a]PYRIDINES HAVING ANTIASTHMATIC AND ANTIINFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-06-10 WO disclosed
EP-0536169-A1 3H,7H]THIAZOLO 3,4-a]PYRIDINES WITH ANTIASTHMATIC AND ANTIINFLAMMATORY ACTIONS ON THE RESPIRATORY TRACT. BOEHRINGER MANNHEIM ITALIA (IT) 1993-04-14 EP disclosed
WO-1993000342-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-01-07 WO disclosed
EP-0519449-A1 2-Amino-4-aryl thiazoles with antiasthmatic and antiinflammatory activities on the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-12-23 EP disclosed
WO-1992018478-A1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-10-29 WO disclosed
WO-1991018906-A1 [3H,7H]THIAZOLO[3,4-a]PYRIDINES WITH ANTIASTHMATIC AND ANTIINFLAMMATORY ACTIONS ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1991-12-12 WO disclosed