SCHEMBL15315976

SCHEMBL15315976

FC(F)(F)c1ccc(-c2nccn2-c2c(-c3ccccc3)cccc2-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.47
FLT1 P17948 2/20 0.47
FLT4 P35916 2/20 0.47
TOP1 P11387 3/20 0.45
KIF11 P52732 1/20 0.45
ALOX15B O15296 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
AKT1 P31749 1/20 0.42
SCN2A Q99250 2/20 0.39
HSD11B1 P28845 1/20 0.39
JAK2 O60674 1/20 0.39
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
BACE1 P56817 1/20 0.37

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
SCHEMBL25564159 0.87 KDR (0.46) KDRFLT1FLT4HSD11B1MAPK9
SCHEMBL3816909 0.85 TOP1 (0.42) KDRFLT1FLT4TOP1AKT1
SCHEMBL15316077 0.83 KDR (0.39) KDRFLT1FLT4TOP1ALOX15B
SCHEMBL15316078 0.80 KDR (0.36) KDRFLT1FLT4TOP1ALOX15B
SCHEMBL21141830 0.76 FLT1 (0.44) KDRFLT1FLT4L3MBTL1
SCHEMBL12797971 0.75 KDR (0.43) KDRFLT1FLT4MAPK9MAPK10
SCHEMBL26521724 0.75 KDR (0.45) KDRFLT1FLT4TOP1KIF11
SCHEMBL15315985 0.74 KDR (0.44) KDRFLT1FLT4L3MBTL1HSD11B1
SCHEMBL3821581 0.74 TOP1 (0.45) KDRFLT1FLT4TOP1L3MBTL1
SCHEMBL16203401 0.74 ALDH1A1 (0.45) KDRFLT1FLT4HSD11B1MAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed
US-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE NFXL1, NFE2L2, ZC3HAV1L KDR 215/4885FLT1 1339/4885FLT4 1423/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.