SCHEMBL2175266

SCHEMBL2175266

COc1ccc(Cn2nc(C(=O)O)cc2[N+](=O)[O-])cc1OC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
P2RY14 Q15391 1/20 0.44
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CASP7 P55210 1/20 0.43
CASP6 P55212 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
PTGER1 P34995 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
LDHA P00338 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL2172233 0.77 CACNA1H (0.46) LMNASMN1; SMN2KMT2AMEN1MAPT
SCHEMBL2173221 0.76 LMNA (0.40) LMNASMN1; SMN2KMT2AMEN1MAPT
SCHEMBL18546508 0.75 ALDH1A1 (0.50) LMNASMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL2172241 0.73 LMNA (0.41) LMNASMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8606107 0.70 LMNA (0.51) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL23910369 0.68 P2RY14 (0.35) SMN1; SMN2P2RY14ALDH1A1PTGER1CYP3A4
SCHEMBL27476484 0.67 LMNA (0.47) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL15814352 0.66 L3MBTL1 (0.37) LMNAKMT2AMEN1P2RY14MAPT
SCHEMBL7345064 0.66 SIGMAR1 (0.51) LMNASMN1; SMN2KMT2AMEN1MAPT
SCHEMBL14119926 0.66 MAPT (0.50) SMN1; SMN2P2RY14MAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973164-B2 Quinoline derivatives ASTRAZENECA AB (SE) 2011-07-05 US disclosed
US-20090076074-A1 QUINOLINE DERIVATIVES ASTRAZENECA AB (SE) 2009-03-19 US disclosed
EP-1994025-A1 QUINOLINE DERIVATIVES AstraZeneca AB (SE) 2008-11-26 EP disclosed
WO-2007099326-A1 QUINOLINE DERIVATIVES ASTRAZENECA AB (SE) 2007-09-07 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-20090076074-A1 QUINOLINE DERIVATIVES RECQL, NQO2, CCNA1 LMNA 1122/4885SMN1; SMN2 2298/4885KMT2A 1159/4885

“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.