SCHEMBL1934201

SCHEMBL1934201

NC(=NO)c1cc(Oc2cccc(C(F)(F)F)c2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.46
PLK4 O00444 1/20 0.46
AURKA O14965 1/20 0.46
MAPK13 O15264 1/20 0.46
JAK2 O60674 1/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
LYN P07948 1/20 0.46
RET P07949 1/20 0.46
ROS1 P08922 1/20 0.46
SRC P12931 1/20 0.46
RPS6KB1 P23443 1/20 0.46
EPHA2 P29317 1/20 0.46
TYK2 P29597 1/20 0.46
AXL P30530 1/20 0.46
FRK P42685 1/20 0.46
SYK P43405 1/20 0.46
MAPK9 P45984 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
SCHEMBL5318462 0.81 MAOB (0.47) MAPTALDH1A1POLBF10GAA
SCHEMBL1935591 0.81 KMO (0.45) ALDH1A1KDM4E
SCHEMBL12439744 0.81 KMO (0.45) ALDH1A1KDM4E
SCHEMBL2337914 0.80 NOS3 (0.50) ALDH1A1POLBTDP1
SCHEMBL13847246 0.80 NOS3 (0.50) ALDH1A1POLBTDP1
SCHEMBL12446917 0.80 NOS3 (0.50) ALDH1A1POLBTDP1
SCHEMBL1935338 0.80 RAF1 (0.40) KDRPLK4AURKAMAPK13MAP4K4
SCHEMBL12439738 0.80 RAF1 (0.40) KDRPLK4AURKAMAPK13MAP4K4
SCHEMBL2335940 0.77 MAPT (0.40) RAF1MAPTALDH1A1L3MBTL1POLB
SCHEMBL13028341 0.77 MAPT (0.40) RAF1MAPTALDH1A1L3MBTL1POLB

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
EP-2332936-B1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2013-09-04 EP disclosed
US-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-07-21 US disclosed
EP-2332936-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2011-06-15 EP 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-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL C5, PRDX1, PRDX4 KDR 4701/4885PLK4 2056/4885AURKA 3781/4885

“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.