SCHEMBL8710207

SCHEMBL8710207

COc1c(N[C@H]2CC[C@@H](C(C)(C)CC(C)(C)C)CC2)ccnc1Cl

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.36
FGFR2 P21802 1/20 0.34
KMT5B Q4FZB7 2/20 0.33
KMT5C Q86Y97 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
GRM1 Q13255 1/20 0.31
DRD2 P14416 2/20 0.30
DRD3 P35462 2/20 0.30
HPGDS O60760 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL9034335 1.00 NSD2 (0.36) NSD2FGFR2KMT5BKMT5CKDM4E
SCHEMBL8710322 1.00 NSD2 (0.36) NSD2FGFR2KMT5BKMT5CKDM4E
SCHEMBL9035632 0.87 FGFR2 (0.34) NSD2FGFR2GRM1DRD2DRD3
SCHEMBL8706052 0.87 FGFR2 (0.34) NSD2FGFR2KDM4EMEN1ALDH1A1
SCHEMBL9035638 0.87 FGFR2 (0.34) NSD2FGFR2GRM1DRD2DRD3
SCHEMBL8416629 0.87 FGFR2 (0.43) NSD2FGFR2KMT5BKMT5CKDM4E
SCHEMBL8417983 0.87 FGFR2 (0.43) NSD2FGFR2KMT5BKMT5CKDM4E
SCHEMBL8416630 0.87 FGFR2 (0.43) NSD2FGFR2KMT5BKMT5CKDM4E
Hydrochloric Acid SCHEMBL8710432 0.86 FGFR2 (0.34) NSD2FGFR2GRM1DRD2DRD3
Hydrochloric Acid SCHEMBL8707219 0.86 FGFR2 (0.34) NSD2FGFR2GRM1DRD2DRD3

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-5723450-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-03-03 US disclosed
EP-0719256-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-1995007891-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed