SCHEMBL5544683

SCHEMBL5544683

O=[N+]([O-])c1[c]cc(N2CCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.56
ALDH1A1 P00352 8/20 0.50
CYP1A2 P05177 3/20 0.50
CYP2C19 P33261 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 3/20 0.49
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.45
CYP2C9 P11712 2/20 0.44
PSMD14 O00487 1/20 0.44
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL3282015 0.85 POLB (0.54) MAPTALDH1A1CYP1A2L3MBTL1LMNA
SCHEMBL16654093 0.81 MAPT (0.47) MAPTALDH1A1LMNAHPGDKMT2A
SCHEMBL378458 0.73 MAPT (0.96) MAPTALDH1A1CYP1A2CYP2C19L3MBTL1
SCHEMBL85552 0.72 MAPT (1.00) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL223626 0.72 MAPT (1.00) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL6607374 0.72 MAPT (1.00) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL1851861 0.69 MAPT (0.89) MAPTALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL20836338 0.69 ALDH1A1 (0.41) MAPTALDH1A1CYP1A2CYP2C19L3MBTL1
SCHEMBL6366966 0.69 ALDH1A1 (0.41) MAPTALDH1A1L3MBTL1LMNAHPGD
SCHEMBL9213288 0.69 ALDH1A1 (0.50) MAPTALDH1A1L3MBTL1LMNAHPGD

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
WO-2006117556-A2 MATERIALS AND METHODS FOR THE PHOTODIRECTED SYNTHESIS OF OLIGONUCLEOTIDE ARRAYS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2006-11-09 WO claimed
US-20070207093-A1 Hydrazone derivatives and uses thereof LINQUAGEN CORP. 2007-09-06 US disclosed
WO-2006117556-A2 MATERIALS AND METHODS FOR THE PHOTODIRECTED SYNTHESIS OF OLIGONUCLEOTIDE ARRAYS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2006-11-09 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-20070207093-A1 Hydrazone derivatives and uses thereof TAS2R1, TAS2R5, TAS1R1 MAPT 4421/4885ALDH1A1 72/4885CYP1A2 630/4885

“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.