SCHEMBL9846298

SCHEMBL9846298

CCc1cc(NCc2nc(C)c(C)cc2OC)c(=O)[nH]c1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 4/20 0.38
PDE3A Q14432 4/20 0.38
MAPT P10636 4/20 0.34
KDM4E B2RXH2 4/20 0.34
APAF1 O14727 1/20 0.34
RECQL P46063 1/20 0.34
PDE10A Q9Y233 7/20 0.34
GAA P10253 2/20 0.34
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CRHR1 P34998 1/20 0.33

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
SCHEMBL9846203 0.91 PDE3B (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846246 0.87 MAPT (0.34) MAPTKDM4EAPAF1RECQLPDE10A
SCHEMBL9680359 0.87 MAPT (0.34) MAPTKDM4EAPAF1RECQLPDE10A
SCHEMBL9846175 0.84 PDE3B (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9281981 0.82 MAPT (0.37) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9168694 0.82 PDE3B (0.42) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846183 0.81 RXFP1 (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846165 0.81 PDE3B (0.41) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9682064 0.78 MAPT (0.34) MAPTKDM4EAPAF1RECQLPDE10A
SCHEMBL9333881 0.76 MAPT (0.35) PDE3BPDE3AMAPTKDM4EAPAF1

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-0462800-A2 Inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1991-12-27 EP disclosed