SCHEMBL6796448

SCHEMBL6796448

CC(C)(C)OC(=O)Nc1cccc(COc2ccc([N+](=O)[O-])cn2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
CYP2C19 P33261 2/20 0.41
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
NPC1 O15118 4/20 0.40
MAPT P10636 4/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 2/20 0.40
GABRA5 P31644 1/20 0.40
MEN1 O00255 2/20 0.38
PABPC1 P11940 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
SLC29A1 Q99808 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37

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
SCHEMBL7086791 0.90 CYP1A2 (0.41) LMNACYP2C19CYP1A2GAANPC1
SCHEMBL7086795 0.80 CYP2C19 (0.40) LMNACYP2C19CYP1A2GAANPC1
SCHEMBL6487610 0.79 MAPT (0.48) LMNACYP1A2GAANPC1MAPT
SCHEMBL115820 0.78 CYP1A2 (0.65) LMNACYP2C19CYP1A2GAANPC1
SCHEMBL6497053 0.77 NPC1 (0.46) NPC1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL20098837 0.75 CDK5 (0.44) GAANPC1RAB9AMEN1KMT2A
SCHEMBL31294842 0.75 CA12 (0.50) CYP2C19MAPTRAB9AMEN1PABPC1
SCHEMBL13141093 0.74 CCR2 (0.41) GAANPC1RAB9AMEN1KMT2A
SCHEMBL10233481 0.74 CA12 (0.48) LMNACYP2C19CYP1A2GAANPC1
SCHEMBL6488833 0.74 SIRT1 (0.40) LMNACYP2C19CYP1A2GAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 US 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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 LMNA 1239/4885CYP2C19 1180/4885CYP1A2 640/4885

“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.