SCHEMBL14867313

SCHEMBL14867313

Cc1ccc(-c2nc(NCc3ccccc3)c3cc(C)ccc3c2[N+](=O)[O-])cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 6/20 0.52
NPSR1 Q6W5P4 2/20 0.50
HPGD P15428 2/20 0.50
BLM P54132 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 3/20 0.46
ALDH1A1 P00352 3/20 0.45
PDE5A O76074 3/20 0.45
POLB P06746 1/20 0.45
HTT P42858 3/20 0.45
NPC1 O15118 1/20 0.45
MAPK1 P28482 2/20 0.43
EGFR P00533 2/20 0.43
APP P05067 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
SCHEMBL12324398 0.84 EGFR (0.57) MAPTNPSR1BLML3MBTL1MEN1
SCHEMBL14867303 0.78 ALDH1A1 (0.47) SMN1; SMN2MAPTNPSR1HPGDL3MBTL1
SCHEMBL14867273 0.74 MAPT (0.44) SMN1; SMN2MAPTNPSR1TDP1MEN1
SCHEMBL14867290 0.74 L3MBTL1 (0.41) SMN1; SMN2MAPTNPSR1L3MBTL1MEN1
SCHEMBL14867274 0.72 HPRT1 (0.39) SMN1; SMN2MAPTMEN1KMT2ALMNA
SCHEMBL13407309 0.70 MAPT (0.59) SMN1; SMN2MAPTNPSR1HPGDBLM
SCHEMBL28469366 0.70 MAPT (0.52) SMN1; SMN2MAPTNPSR1BLMTDP1
SCHEMBL14867304 0.69 S1PR4 (0.35) SMN1; SMN2MAPTNPSR1MEN1KMT2A
SCHEMBL14867280 0.69 CASR (0.37) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL15743967 0.67 MAPT (0.56) SMN1; SMN2MAPTNPSR1HPGDL3MBTL1

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-8883763-B2 Use of isoquinolones for preparing drugs, novel isoquinolones and method for synthesising same UNIVERSITE JOSEPH FOURIER (FR) 2014-11-11 US disclosed
US-20130096083-A1 USE OF ISOQUINOLONES FOR PREPARING DRUGS, NOVEL ISOQUINOLONES AND METHOD FOR SYNTHESISING SAME UNIVERSITE JOSEPH FOURIER (FR) 2013-04-18 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-20130096083-A1 USE OF ISOQUINOLONES FOR PREPARING DRUGS, NOVEL ISOQUINOLONES AND METHOD FOR SYNTHESISING SAME GNAQ, HCCS, SDHA SMN1; SMN2 4740/4885MAPT 4086/4885NPSR1 3494/4885

“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.