SCHEMBL7469883

SCHEMBL7469883

Fc1ccnc(Oc2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.46
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPK14 Q16539 6/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
APAF1 O14727 1/20 0.41
SCN9A Q15858 1/20 0.41
LTA4H P09960 2/20 0.41
TSHR P16473 1/20 0.41
PAX8 Q06710 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HTT P42858 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL29018765 0.83 MAPT (0.39) MAPTL3MBTL1MEN1KMT2AAPAF1
SCHEMBL4272019 0.78 ALDH1A1 (0.47) MAPK8MEN1KMT2AAPAF1SCN9A
SCHEMBL9228553 0.77 MAPK8 (0.46) MAPK8MAPTL3MBTL1MEN1KMT2A
SCHEMBL9120208 0.77 SCN9A (0.49) MAPK8MAPTL3MBTL1MEN1KMT2A
SCHEMBL26149616 0.77 MAPK8 (0.46) MAPK8MAPTL3MBTL1MEN1KMT2A
SCHEMBL1456723 0.77 SCN9A (0.67) MAPK8MEN1KMT2AAPAF1SCN9A
SCHEMBL667594 0.77 MEN1 (0.64) MAPK8MAPTMEN1KMT2AAPAF1
SCHEMBL3665766 0.77 BLM (0.47) MAPK8MAPTL3MBTL1MEN1KMT2A
SCHEMBL5119715 0.76 MEN1 (0.57) MAPK8MAPTL3MBTL1MAPK14MEN1
SCHEMBL30411682 0.74 L3MBTL1 (0.49) MAPK8L3MBTL1MEN1KMT2ALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194417-A1 PHENOXY FLUOROPYRIMIDINES BAYER AG (DE) 2002-04-10 EP disclosed
EP-1194417-A1 PHENOXY FLUOROPYRIMIDINES BAYER AG (DE) 2002-04-10 EP disclosed
WO-2000078733-A1 PHENOXY FLUOROPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2000-12-28 WO disclosed
WO-2000078733-A1 PHENOXY FLUOROPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2000-12-28 WO disclosed