SCHEMBL16022018

SCHEMBL16022018

Cn1ncnc1NC(=O)c1cn(C)c(=O)n(-c2cccc(F)c2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AXL P30530 9/20 0.37
MET P08581 6/20 0.37
MERTK Q12866 6/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
CD274 Q9NZQ7 1/20 0.33
TYRO3 Q06418 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SCN9A Q15858 1/20 0.32

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
SCHEMBL17427479 0.85 POLB (0.47) AXLMETLMNANPC1ALDH1A1
SCHEMBL17427475 0.82 TYRO3 (0.41) AXLMETMERTKTYRO3RAB9A
SCHEMBL17427487 0.70 RIPK1 (0.35) METLMNAGAA
SCHEMBL16022005 0.69 POLB (0.44) METLMNANPC1ALDH1A1RAB9A
SCHEMBL16022003 0.67 HCAR1 (0.40) LMNAKDM4ENPC1ALDH1A1TP53
SCHEMBL17427482 0.66 TYRO3 (0.38) METPKMTYRO3NPC1ALDH1A1
SCHEMBL17409840 0.64 KMT2A (0.48) KDM4ENPC1ALDH1A1GLARAB9A
SCHEMBL16022024 0.64 SMN1; SMN2 (0.40) LMNAKDM4ENPC1ALDH1A1RAB9A
SCHEMBL17427481 0.64 HPGD (0.53) AXLMETMERTKLMNAKDM4E
SCHEMBL17427477 0.63 MET (0.38) AXLMETLMNATYRO3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 US disclosed
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 US disclosed
WO-2014135654-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2014-09-12 WO 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-20160009693-A1 HERBICIDAL COMPOUNDS DDT, HAX1, CYP4X1 AXL 3850/4885MET 3504/4885MERTK 4541/4885

“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.