SCHEMBL1154526

SCHEMBL1154526

N#Cc1c(N)cccc1COc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.47
MAOB P27338 8/20 0.44
MRGPRX4 Q96LA9 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
XDH P47989 1/20 0.39
APP P05067 1/20 0.37
CYP19A1 P11511 1/20 0.37
ALDH3A1 P30838 1/20 0.37
DHFR P00374 1/20 0.37
OPRL1 P41146 1/20 0.36

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
SCHEMBL1155388 0.86 DHFR (0.50) TLR8MAOBMRGPRX4NPC1RAB9A
SCHEMBL1154799 0.85 CD274 (0.43) TLR8MAOBNPC1RAB9A
SCHEMBL1154363 0.85 MAOB (0.44) TLR8MAOBNPC1RAB9AAPP
SCHEMBL1155105 0.85 KCNH2 (0.43) TLR8MAOBNPC1RAB9ACYP19A1
SCHEMBL1154847 0.81 MRGPRX4 (0.44) TLR8MAOBMRGPRX4NPC1RAB9A
SCHEMBL1154781 0.79 MRGPRX4 (0.52) MRGPRX4NPC1RAB9A
SCHEMBL1155040 0.78 DCPS (0.49) TLR8MRGPRX4NPC1RAB9A
SCHEMBL1155121 0.77 MAOB (0.47) TLR8MAOBMRGPRX4NPC1RAB9A
SCHEMBL3769328 0.73 F2 (0.53) MAOBNPC1RAB9AAPP
SCHEMBL1155237 0.72 PLAU (0.42) MRGPRX4NPC1RAB9AAPPDHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3121176-A1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY Families of Spinal Muscular Atrophy (US) 2017-01-25 EP disclosed
EP-1765810-B1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-17 EP disclosed
EP-2514748-B1 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-10 EP disclosed
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-06-02 US disclosed
US-9067897-B2 2,4-Diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2015-06-30 US disclosed
EP-2514748-A1 2,4-diaminoquinazolines for spinal muscular atrophy Families of Spinal Muscular Atrophy (US) 2012-10-24 EP disclosed
US-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-05-12 US disclosed
US-7888366-B2 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-02-15 US disclosed
EP-1765810-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY Decode Chemistry, Inc. (US) 2007-03-28 EP disclosed
WO-2005123724-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2005-12-29 WO disclosed
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy DECODE CHEMISTRY, INC. (US) 2005-12-29 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 (3 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-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B TLR8 4606/4885MAOB 493/4885MRGPRX4 1940/4885
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B TLR8 4606/4885MAOB 493/4885MRGPRX4 1940/4885
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy SMN1; SMN2, MUSK, MYO3B TLR8 4606/4885MAOB 493/4885MRGPRX4 1940/4885

“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.