SCHEMBL4746291

SCHEMBL4746291

O=c1nc2n(CCCN3CCCC3)c3cc(Cl)ccc3nc-2c(=O)n1CCCN1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 6/20 0.49
NPY1R P25929 1/20 0.41
KCNH2 Q12809 1/20 0.40
MC4R P32245 2/20 0.40
GSR P00390 3/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL4744550 0.92 TMEM97 (0.47) TMEM97NPY1RKCNH2MC4RGSR
SCHEMBL4748253 0.85 GSR (0.48) TMEM97NPY1RMC4RGSR
SCHEMBL4744199 0.83 KCNH2 (0.48) TMEM97NPY1RKCNH2MC4RGSR
SCHEMBL4747565 0.83 GSR (0.48) TMEM97GSR
SCHEMBL4748220 0.83 GSR (0.48) TMEM97KCNH2MC4RGSR
SCHEMBL1050380 0.83 TMEM97 (0.47) TMEM97NPY1RKCNH2MC4RTDP1
SCHEMBL4743759 0.81 MPO (0.43) GSR
SCHEMBL4747148 0.76 HRH3 (0.39) MC4R
SCHEMBL4744200 0.76 GSR (0.46) GSR
SCHEMBL4747828 0.74 GSR (0.45) GSR

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
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed