SCHEMBL8840466

SCHEMBL8840466

COCc1nccc(N[C@H]2CC[C@@H](C(C)(C)C)CC2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 1/20 0.41
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GRM1 Q13255 1/20 0.34
NSD2 O96028 1/20 0.33
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 0.31
CNR2 P34972 1/20 0.31
ALPL P05186 1/20 0.30
CYP19A1 P11511 1/20 0.30
PDE1B Q01064 1/20 0.30
CDC7 O00311 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
SCHEMBL8840461 1.00 FGFR2 (0.41) FGFR2ALDH1A1MEN1LMNAGAA
SCHEMBL8840574 0.90 FGFR2 (0.33) FGFR2ALDH1A1MEN1GAAKMT2A
SCHEMBL8840569 0.90 FGFR2 (0.33) FGFR2ALDH1A1MEN1GAAKMT2A
Hydrochloric Acid SCHEMBL8415218 0.88 FGFR2 (0.43) FGFR2ALDH1A1MEN1LMNAGAA
Hydrochloric Acid SCHEMBL8415219 0.88 FGFR2 (0.43) FGFR2ALDH1A1MEN1LMNAGAA
Hydrochloric Acid SCHEMBL8840530 0.88 FGFR2 (0.32) FGFR2NSD2
Hydrochloric Acid SCHEMBL8840518 0.88 FGFR2 (0.32) FGFR2NSD2
SCHEMBL8840592 0.86 GRM1 (0.33) FGFR2GRM1NSD2DRD2DRD3
SCHEMBL8840570 0.86 FGFR2 (0.37) FGFR2ALDH1A1MEN1LMNAGAA
SCHEMBL8840573 0.86 FGFR2 (0.37) FGFR2ALDH1A1MEN1LMNAGAA

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-5650417-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1997-07-22 US disclosed
EP-0719255-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-1995007890-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed