SCHEMBL1361740

SCHEMBL1361740

Cc1cc(O)cc(Br)c1NC(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
KMT2A Q03164 7/20 0.60
MEN1 O00255 6/20 0.60
SMN1; SMN2 Q16637 1/20 0.55
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
MAPT P10636 3/20 0.54
THRA P10827 1/20 0.53
POLB P06746 1/20 0.52
BLM P54132 1/20 0.52
CYP3A4 P08684 2/20 0.50
AKR1C4 P17516 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50
AKR1C1 Q04828 1/20 0.50
HTT P42858 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL1361393 0.81 ALDH1A1 (0.53) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL1360526 0.80 KDM4E (0.56) ALDH1A1KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL1361514 0.78 KMT2A (0.56) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL15695722 0.78 ALOX5 (0.57) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL27657642 0.77 KMT2A (0.88) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL1842685 0.76 ALDH1A1 (0.57) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL27903466 0.76 KMT2A (0.86) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL8711130 0.76 MEN1 (0.86) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL1825660 0.75 ABCC9 (0.58) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL1823158 0.75 ABCC9 (0.64) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2

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 4 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
CN-101203484-A Amide derivative and pesticide containing such compound MITSUI CHEMICALS INC (JP) 2008-06-18 CN 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 ALDH1A1 427/4885L3MBTL1 181/4885KMT2A 271/4885

“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.