SCHEMBL6757771

SCHEMBL6757771

COc1ccc2[nH]c(NCc3cccc([N+](=O)[O-])c3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
IRAK4 Q9NWZ3 1/20 0.55
EGFR P00533 1/20 0.55
IGF1R P08069 1/20 0.55
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 3/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.52
CRHBP P24387 1/20 0.52
CRHR2 Q13324 1/20 0.52
ADORA2A P29274 1/20 0.48
RIPK1 Q13546 3/20 0.47
CCNT1 O60563 1/20 0.47
CDK9 P50750 1/20 0.47
GAA P10253 1/20 0.45
GABRP O00591 1/20 0.45
GABRD O14764 1/20 0.45

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
SCHEMBL6756970 0.85 IRAK4 (0.52) TP53RAB9ASMN1; SMN2IRAK4EGFR
SCHEMBL2025299 0.84 RAB9A (0.63) TP53RAB9ASMN1; SMN2IRAK4MEN1
SCHEMBL6759841 0.82 RAB9A (0.62) TP53RAB9ASMN1; SMN2EGFRIGF1R
SCHEMBL25967687 0.79 IRAK4 (0.85) RAB9ASMN1; SMN2IRAK4MEN1KMT2A
SCHEMBL13812984 0.75 MAPT (0.62) RAB9AMEN1KMT2AMAPTALDH1A1
SCHEMBL17487306 0.75 HDAC6 (0.53) TP53RAB9ASMN1; SMN2EGFRMEN1
SCHEMBL18254877 0.74 ROCK2 (0.56) TP53RAB9ASMN1; SMN2EGFRIGF1R
SCHEMBL17488031 0.74 RIPK1 (0.51) TP53RAB9ASMN1; SMN2IRAK4EGFR
SCHEMBL18254878 0.74 ROCK2 (0.59) TP53RAB9ASMN1; SMN2
SCHEMBL16744013 0.73 RAB9A (0.63) TP53RAB9ASMN1; SMN2IRAK4MEN1

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-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 TP53 2814/4885RAB9A 1818/4885SMN1; SMN2 2625/4885

“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.