SCHEMBL5448276

SCHEMBL5448276

O=C(NO)c1ccc(-c2ccc(CNC3CC3)cc2)o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.55
RAB9A P51151 5/20 0.51
NPC1 O15118 4/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
KDM4E B2RXH2 6/20 0.47
ALDH1A1 P00352 6/20 0.47
HPGD P15428 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 3/20 0.47
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 5/20 0.47
HRH3 Q9Y5N1 1/20 0.46
MAPK1 P28482 1/20 0.43
MMP13 P45452 1/20 0.42
MAPK11 Q15759 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL5448334 0.77 KDM4E (0.58) RAB9ANPC1KMT2AMEN1KDM4E
SCHEMBL5453938 0.76 KMT2A (0.55) RAB9ANPC1L3MBTL1KMT2AMEN1
SCHEMBL5452549 0.76 HDAC3 (0.56) RAB9ANPC1L3MBTL1KMT2AMEN1
SCHEMBL5446773 0.76 KDM4E (0.48) HDAC1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5446738 0.75 ALDH1A1 (0.51) HDAC1RAB9ANPC1KDM4EALDH1A1
SCHEMBL5452596 0.74 HDAC1 (0.57) HDAC1RAB9ANPC1KMT2AMEN1
SCHEMBL5444736 0.74 MAPT (0.55) HDAC1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL14106943 0.74 ALDH1A1 (0.62) HDAC1NPC1KMT2AMEN1KDM4E
SCHEMBL5456286 0.73 KDM4E (0.45) HDAC1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL5450998 0.73 HDAC1 (0.57) HDAC1KDM4EALDH1A1HPGDSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications A*BIO PTE LTD. (SG) 2007-07-19 US disclosed
US-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications A*BIO PTE LTD. (SG) 2007-07-19 US disclosed
US-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications A*BIO PTE LTD. (SG) 2007-07-19 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-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications HDAC1, HDAC11, HDAC2 HDAC1 1/4885RAB9A 4613/4885NPC1 2195/4885

“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.