SCHEMBL7078152

SCHEMBL7078152

CCc1ccn(Cc2ccccc2)c(=O)c1F

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.54
VEGFA P15692 4/20 0.51
EGLN1 Q9GZT9 4/20 0.51
TP53 P04637 2/20 0.49
LMNA P02545 1/20 0.49
THRB P10828 1/20 0.49
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
BRD4 O60885 2/20 0.47
CYP2D6 P10635 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.46
BRD2 P25440 1/20 0.46
BRD3 Q15059 1/20 0.46
BRDT Q58F21 1/20 0.46

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
SCHEMBL14900099 0.82 EGLN1 (0.69) MAPK14VEGFAEGLN1TP53LMNA
SCHEMBL5341956 0.75 SMN1; SMN2 (0.50) MAPK14LMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL4470835 0.74 MAPK14 (0.57) MAPK14VEGFAEGLN1TP53THRB
SCHEMBL28486488 0.73 MAPK14 (0.60) MAPK14VEGFAEGLN1TP53LMNA
SCHEMBL16281890 0.72 EGLN1 (0.60) MAPK14VEGFAEGLN1TP53LMNA
SCHEMBL4469481 0.72 MAPK14 (0.55) MAPK14VEGFAEGLN1TP53THRB
SCHEMBL18347240 0.71 MAPK14 (0.56) MAPK14TP53LMNAKDM4EMEN1
SCHEMBL12594186 0.71 MAPK14 (0.71) MAPK14EGLN1TP53KDM4EMEN1
SCHEMBL4382314 0.71 MAPK14 (0.57) MAPK14VEGFAEGLN1TP53LMNA
SCHEMBL12598814 0.71 EGLN1 (0.68) MAPK14VEGFAEGLN1TP53LMNA

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-0871625-B1 PREPARATION OF TRIAZOLES BY ORGANOMETALLIC ADDITION TO KETONES AND INTERMEDIATES THEREFOR PFIZER RES ANDDEVELOPMENT COMP (IE) 2003-12-17 EP disclosed