SCHEMBL8825752

SCHEMBL8825752

CCNc1cc2ncnc(N3CCCCC3)c2cc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 8/20 0.60
MAPT P10636 5/20 0.53
ACHE P22303 2/20 0.46
BACE1 P56817 2/20 0.46
ALDH1A1 P00352 5/20 0.45
MAPK1 P28482 2/20 0.45
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KIT P10721 1/20 0.40
PDGFRA P16234 1/20 0.40
FLT3 P36888 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL8825785 0.91 PDGFRB (0.58) PDGFRBMAPTACHEBACE1ALDH1A1
SCHEMBL2920292 0.89 PDGFRB (0.59) PDGFRBMAPTACHEBACE1ALDH1A1
SCHEMBL8825827 0.86 PDGFRB (0.68) PDGFRBMAPTACHEBACE1ALDH1A1
SCHEMBL9224976 0.83 PDGFRB (0.64) PDGFRBMAPTACHEBACE1MEN1
SCHEMBL8825610 0.82 PDGFRB (0.61) PDGFRBMAPTACHEBACE1ALDH1A1
SCHEMBL2917680 0.82 PDGFRB (0.64) PDGFRBMAPTACHEBACE1ALDH1A1
SCHEMBL7518944 0.80 MAPT (0.54) PDGFRBMAPTALDH1A1MAPK1HTT
SCHEMBL8825617 0.80 PIK3CA (0.59) PDGFRBMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL7522631 0.79 MAPT (0.55) PDGFRBMAPTALDH1A1MAPK1HTT
SCHEMBL7530560 0.79 EGFR (0.48) PDGFRBMAPTACHEBACE1ALDH1A1

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
US-5661147-A CYCLIC GUANOSINE MONOPHOSPHATE-SPECIFIC PHOSPHODIESTERASE INHIBITOR; TREATING CARDIOVASCULAR DISORDER KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-08-26 US disclosed
EP-0668280-A1 IMIDAZOQUINAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-08-23 EP disclosed