SCHEMBL8290704

SCHEMBL8290704

O=C(COc1ccc(Br)cc1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
KDM4E B2RXH2 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
MAPT P10636 1/20 0.58
POLB P06746 1/20 0.58
ALPL P05186 1/20 0.56
TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL1713424 0.85 ALDH1A1 (0.63) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL15300921 0.85 ALDH1A1 (0.67) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL1257639 0.82 LMNA (0.63) SMN1; SMN2MEN1KMT2A
SCHEMBL1255820 0.82 ATF4 (0.63) ALDH1A1MEN1KMT2A
SCHEMBL13320162 0.82 HDAC1 (0.73) ALDH1A1MEN1KMT2AMAPT
SCHEMBL19275848 0.82 HDAC1 (0.51) ALDH1A1MEN1KMT2AALPL
SCHEMBL6612298 0.82 RAB9A (0.67) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL216783 0.82 KMT2A (0.65) MEN1KMT2AALPL
SCHEMBL13382671 0.82 POLB (0.54) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL18177840 0.80 ALDH1A1 (0.76) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A

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-20070037752-A1 Novel alanyl-amino peptidase inhibitors for functionally influencing different cells and treating immunological, inflammatory, neuronal, and other diseases KEYNEUROTEK PHARMACEUTICALS AG (DE) 2007-02-15 US disclosed
US-20070037752-A1 Novel alanyl-amino peptidase inhibitors for functionally influencing different cells and treating immunological, inflammatory, neuronal, and other diseases KEYNEUROTEK PHARMACEUTICALS AG (DE) 2007-02-15 US disclosed
WO-2005037257-A2 NOVEL ALANYL-AMINO PEPTIDASE INHIBITORS FOR FUNCTIONALLY INFLUENCING DIFFERENT CELLS AND TREATING IMMUNOLOGICAL, INFLAMMATORY, NEURONAL, AND OTHER DISEASES IMTM GMBH (DE) 2005-04-28 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-20070037752-A1 Novel alanyl-amino peptidase inhibitors for functionally influencing different cells and treating immunological, inflammatory, neuronal, and other diseases DNPEP, PREP, ANPEP ALDH1A1 1025/4885KDM4E 3461/4885SMN1; SMN2 2829/4885

“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.