SCHEMBL13915768

SCHEMBL13915768

COc1ccc(NC(C)=O)cc1Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.67
MEN1 O00255 9/20 0.67
GAA P10253 1/20 0.67
PKM P14618 1/20 0.67
ATM Q13315 1/20 0.58
MAPT P10636 8/20 0.58
POLB P06746 3/20 0.58
MAPK1 P28482 2/20 0.58
BLM P54132 1/20 0.58
LMNA P02545 3/20 0.57
ALOX5 P09917 1/20 0.57
ALDH1A1 P00352 4/20 0.54
HSP90AA1 P07900 1/20 0.54
SETD7 Q8WTS6 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PDGFRA P16234 1/20 0.53
KDR P35968 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL4688917 0.90 MEN1 (0.58) KMT2AMEN1GAAPKMMAPT
SCHEMBL4688915 0.90 MEN1 (0.58) KMT2AMEN1GAAPKMMAPT
SCHEMBL4687906 0.85 MEN1 (0.58) KMT2AMEN1GAAPKMMAPT
SCHEMBL4687907 0.85 MEN1 (0.58) KMT2AMEN1GAAPKMMAPT
SCHEMBL9367406 0.82 KMT2A (0.77) KMT2AMEN1GAAPKMMAPT
SCHEMBL4232078 0.82 KMT2A (0.55) KMT2AMEN1GAAPKMMAPT
SCHEMBL13915770 0.81 MAPT (0.57) KMT2AMEN1GAAPKMMAPT
SCHEMBL4787488 0.81 TBXA2R (0.61) KMT2AMEN1MAPTPOLBMAPK1
SCHEMBL3139234 0.80 KMT2A (0.74) KMT2AMEN1GAAPKMATM
SCHEMBL13915773 0.80 TLR9 (0.59) KMT2AMEN1MAPTPOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504416-B2 4-substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2009-03-17 US disclosed
US-7504416-B2 4-substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2009-03-17 US disclosed
US-20080027054-A1 4-Substituted quinolines as antitumor agents ASTRAZENECA AB 2008-01-31 US disclosed
US-20080027054-A1 4-Substituted quinolines as antitumor agents ASTRAZENECA AB 2008-01-31 US disclosed
US-7253184-B2 4-Substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2007-08-07 US disclosed
US-7253184-B2 4-Substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2007-08-07 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-20080027054-A1 4-Substituted quinolines as antitumor agents CCNY, TPD52L2, H1-10 KMT2A 959/4885MEN1 953/4885GAA 2017/4885

“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.