SCHEMBL7079684

SCHEMBL7079684

O=C(c1ccc([N+](=O)[O-])cc1Cl)n1cccc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 4/20 0.49
TP53 P04637 2/20 0.49
MAPT P10636 3/20 0.49
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 1/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
NPC1 O15118 2/20 0.47
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL3427781 0.78 MAPT (0.72) KMT2ARAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL7079327 0.77 KMT2A (0.51) KMT2ARAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL752917 0.77 KMT2A (0.72) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL231457 0.77 KMT2A (0.72) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL4029063 0.77 MAPT (0.70) KMT2ARAB9ASMN1; SMN2ALDH1A1MAPT
Aklomide SCHEMBL328368 0.76 KMT2A (1.00) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
Potassium Ion SCHEMBL11056843 0.76 KMT2A (0.70) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL8447117 0.76 KMT2A (0.70) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL11054244 0.76 KMT2A (0.70) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL480106 0.76 KMT2A (0.70) KMT2ARAB9ASMN1; SMN2HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073832-A1 Novel aminophenyl ketone derivatives LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2003-04-17 US disclosed
WO-2002083622-A2 NOVEL AMINOPHENYL KETONE DERIVATIVES LEO PHARMA A/S (DK) 2002-10-24 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-20030073832-A1 Novel aminophenyl ketone derivatives MAPKAPK2, MAP3K2, MAP3K1 KMT2A 1701/4885RAB9A 3059/4885SMN1; SMN2 4425/4885

“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.