SCHEMBL8417815

SCHEMBL8417815

CCOc1c(N[C@H]2CC[C@@H](C(C)(C)C)CC2)ccnc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 1/20 0.38
NSD2 O96028 1/20 0.36
NOS2 P35228 4/20 0.34
NOS1 P29475 3/20 0.34
ALPL P05186 1/20 0.34
CYP19A1 P11511 1/20 0.34
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
NOS3 P29474 1/20 0.33
MAPT P10636 1/20 0.33
LRRK2 Q5S007 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
ALOX12 P18054 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CNR2 P34972 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GRM1 Q13255 1/20 0.32
S1PR5 Q9H228 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
SCHEMBL8416634 1.00 FGFR2 (0.38) FGFR2NSD2NOS2NOS1ALPL
SCHEMBL8416632 1.00 FGFR2 (0.38) FGFR2NSD2NOS2NOS1ALPL
SCHEMBL8705041 0.90 NSD2 (0.35) FGFR2NSD2NOS2NOS1MEN1
SCHEMBL8705038 0.90 NSD2 (0.35) FGFR2NSD2NOS2NOS1MEN1
SCHEMBL8417986 0.87 FGFR2 (0.44) FGFR2NSD2ALPLMEN1ALDH1A1
SCHEMBL8417988 0.87 FGFR2 (0.44) FGFR2NSD2ALPLMEN1ALDH1A1
SCHEMBL9033873 0.84 FGFR2 (0.42) FGFR2NSD2ALPLMEN1ALDH1A1
SCHEMBL8708642 0.84 FGFR2 (0.42) FGFR2NSD2ALPLMEN1ALDH1A1
SCHEMBL8840482 0.83 FGFR2 (0.36) FGFR2NSD2NOS2NOS1CYP19A1
SCHEMBL8840472 0.83 FGFR2 (0.36) FGFR2NSD2NOS2NOS1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5877322-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1999-03-02 US disclosed
EP-0719257-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1996-07-03 EP disclosed
WO-1995007892-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed