SCHEMBL1359640

SCHEMBL1359640

O=C(Nc1c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)c2ncccc12)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
KDR P35968 1/20 0.53
ABCC9 O60706 1/20 0.53
ABCC8 Q09428 1/20 0.53
KCNJ11 Q14654 1/20 0.53
KCNJ8 Q15842 1/20 0.53
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
KDM4E B2RXH2 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
L3MBTL1 Q9Y468 4/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
ALOX12 P18054 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
HSP90AA1 P07900 1/20 0.43

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
SCHEMBL1361280 0.85 PTGS1 (0.42) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL1359644 0.79 MEN1 (0.47) RAB9AKCNJ11KMT2AMEN1KDM4E
SCHEMBL1767250 0.77 ABCC9 (0.53) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL289758 0.76 ABCC9 (0.53) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL1820368 0.74 ABCC9 (0.62) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL1766897 0.73 ABCC9 (0.53) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL4180513 0.72 ABCC9 (0.48) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL2113906 0.72 ABCC9 (0.53) RAB9AABCC9ABCC8KCNJ11KCNJ8
SCHEMBL698112 0.72 ABCC9 (0.50) RAB9AKDRABCC9ABCC8KCNJ11
SCHEMBL4182929 0.72 ABCC9 (0.48) RAB9AABCC9ABCC8KCNJ11KCNJ8

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 RAB9A 1871/4885KDR 3237/4885ABCC9 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.