SCHEMBL16404469

SCHEMBL16404469

FC(F)(F)c1ccc2c(Nc3ccccc3)nc(-c3ccccc3)nc2c1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 15/20 0.76
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
PDE5A O76074 2/20 0.63
KDM1A O60341 2/20 0.61
TGFBR1 P36897 1/20 0.56
MAPK14 Q16539 1/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL1063103 0.80 ABCG2 (1.00) ABCG2MEN1KMT2APDE5AKDM1A
SCHEMBL16404313 0.80 ABCG2 (0.74) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL3971162 0.80 ABCG2 (0.74) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL1083755 0.79 ABCG2 (1.00) ABCG2PDE5AKDM4EALDH1A1POLB
SCHEMBL4085140 0.79 ABCG2 (0.83) ABCG2MEN1KMT2APDE5AKDM1A
SCHEMBL16404289 0.77 ABCG2 (0.71) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL19209593 0.77 GAA (0.52) ABCG2MEN1KMT2AKDM4EALDH1A1
SCHEMBL11088081 0.77 EGFR (0.69) ABCG2MAPK14KDM4E
SCHEMBL12316882 0.77 ABCG2 (0.81) ABCG2PDE5AKDM4EALDH1A1HPGD
SCHEMBL16404487 0.76 ABCG2 (0.76) ABCG2MEN1KMT2APDE5AKDM1A

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-8936840-B2 Retardation film, polarizing plate, liquid crystal display device, and compound Konica Minolta, Inc. (JP) 2015-01-20 US disclosed