SCHEMBL1360922

SCHEMBL1360922

O=C(Nc1c(OC(C(F)(F)F)C(F)(F)F)ccnc1Br)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.47
MEN1 O00255 7/20 0.47
ABCC9 O60706 1/20 0.46
ABCC8 Q09428 1/20 0.46
KCNJ11 Q14654 1/20 0.46
KCNJ8 Q15842 1/20 0.46
RAB9A P51151 5/20 0.46
KDR P35968 1/20 0.46
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
MAPT P10636 4/20 0.44
NPC1 O15118 4/20 0.44
THRB P10828 1/20 0.44
MAPK9 P45984 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SETD7 Q8WTS6 1/20 0.44
BLM P54132 1/20 0.44
PYGL P06737 1/20 0.44

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
SCHEMBL1360508 0.85 PTGS1 (0.46) KMT2AMEN1POLBSMN1; SMN2MAPT
SCHEMBL25822054 0.73 KMT2A (0.66) KMT2AMEN1RAB9AKDRPOLB
SCHEMBL1360480 0.71 MAPT (0.52) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL1820368 0.70 ABCC9 (0.62) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL1812513 0.69 ALDH1A1 (0.54) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL10279317 0.69 RAB9A (0.62) KMT2AMEN1RAB9AKDRPOLB
SCHEMBL1359640 0.69 RAB9A (0.53) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL1813478 0.68 ALDH1A1 (0.53) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL289758 0.68 ABCC9 (0.53) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL2113906 0.68 ABCC9 (0.53) KMT2AMEN1ABCC9ABCC8KCNJ11

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-8067638-B2 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2011-11-29 US disclosed
US-20090233962-A1 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed
EP-1911751-A1 AMIDE DERIVATIVE AND PESTICIDE CONTAINING SUCH COMPOUND Mitsui Chemicals, Inc. (JP) 2008-04-16 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-20090233962-A1 Amide derivative and insecticide containing the same CYP1A1, CYP4B1, CYP2E1 KMT2A 271/4885MEN1 4042/4885ABCC9 512/4885

“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.