SCHEMBL4976891

SCHEMBL4976891

COCc1cc(NC(=O)Cn2cnc3cccc([N+](=O)[O-])c32)cc(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
PKM P14618 1/20 0.46
ERO1A Q96HE7 1/20 0.42
POLB P06746 2/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 6/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPK1 P28482 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.39
FPR1 P21462 1/20 0.39
FPR2 P25090 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3039696 0.93 SMN1; SMN2 (0.51) SMN1; SMN2L3MBTL1PKMERO1APOLB
SCHEMBL4976503 0.90 SMN1; SMN2 (0.53) SMN1; SMN2L3MBTL1PKMPOLBALDH1A1
SCHEMBL4979265 0.89 SMN1; SMN2 (0.46) SMN1; SMN2L3MBTL1PKMERO1APOLB
SCHEMBL4456795 0.88 SMN1; SMN2 (0.55) SMN1; SMN2L3MBTL1PKMPOLBALDH1A1
SCHEMBL4974926 0.87 RXFP1 (0.45) SMN1; SMN2L3MBTL1PKMPOLBALDH1A1
SCHEMBL3038462 0.86 RXFP1 (0.45) SMN1; SMN2L3MBTL1PKMERO1APOLB
SCHEMBL3038427 0.86 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1PKMPOLBALDH1A1
SCHEMBL4973779 0.84 SMN1; SMN2 (0.43) SMN1; SMN2L3MBTL1PKMERO1APOLB
SCHEMBL4976010 0.84 SMN1; SMN2 (0.43) SMN1; SMN2L3MBTL1PKMERO1APOLB
SCHEMBL4977021 0.83 SMN1; SMN2 (0.42) SMN1; SMN2L3MBTL1PKMERO1APOLB

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-20080015222-A1 New Heterocyclic Amides ASTRAZENECA AB (SE) 2008-01-17 US claimed
EP-1797067-A1 NEW HETEROCYCLIC AMIDES AstraZeneca AB (SE) 2007-06-20 EP claimed
WO-2006033620-A1 NEW HETEROCYCLIC AMIDES ASTRAZENECA AB (SE) 2006-03-30 WO claimed
US-20080015222-A1 New Heterocyclic Amides ASTRAZENECA AB (SE) 2008-01-17 US disclosed
EP-1797067-A1 NEW HETEROCYCLIC AMIDES AstraZeneca AB (SE) 2007-06-20 EP disclosed
WO-2006033620-A1 NEW HETEROCYCLIC AMIDES ASTRAZENECA AB (SE) 2006-03-30 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-20080015222-A1 New Heterocyclic Amides AADAC, AVPR2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 SMN1; SMN2 4341/4885L3MBTL1 4863/4885PKM 1562/4885

“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.