SCHEMBL7978765

SCHEMBL7978765

CN(c1cccc(C(F)(F)F)c1)c1cc(Oc2ccc(C(F)(F)F)cc2)ncn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.56
MAPK14 Q16539 9/20 0.56
TNNI3K Q59H18 9/20 0.56
BRAF P15056 8/20 0.56
EGFR P00533 2/20 0.47
CSF1R P07333 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LIPE Q05469 3/20 0.42
SCN9A Q15858 1/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41

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
SCHEMBL7776080 0.92 KDR (0.52) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7781113 0.89 KDR (0.50) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7776073 0.87 KDR (0.48) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7780252 0.86 KDR (0.48) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7978762 0.83 EGFR (0.47) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7775742 0.82 KDR (0.48) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7780255 0.80 KDR (0.46) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7783042 0.79 KDR (0.45) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7783043 0.78 KDR (0.44) KDRMAPK14TNNI3KBRAFEGFR
SCHEMBL7782549 0.77 RXRA (0.54) KDRMAPK14TNNI3KBRAFEGFR

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
US-6281219-B1 4,6-BIS-ARYL-PYRIMIDINES WHEREIN THE AROMATIC GROUPS ARE ATTACHED VIA TWO LINKING GROUPS WHICH ARE DIFFERENT FROM ONE ANOTHER. AMERICAN CYANAMID CO. 2001-08-28 US disclosed