SCHEMBL1154530

SCHEMBL1154530

N#Cc1c(F)cccc1OCc1cc(F)cc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
DHFR P00374 1/20 0.45
DCPS Q96C86 1/20 0.45
MRGPRX4 Q96LA9 3/20 0.43
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
ADRB1 P08588 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
IDO1 P14902 1/20 0.37
LRRK2 Q5S007 1/20 0.36
VEGFA P15692 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 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
SCHEMBL1154507 0.90 MAPK14 (0.54) MAPK14NPC1RAB9AMRGPRX4LMNA
SCHEMBL1155271 0.88 NPC1 (0.55) MAPK14NPC1RAB9AMRGPRX4FFAR1
SCHEMBL5222695 0.85 MAPK14 (0.40) MAPK14NPC1RAB9AMRGPRX4LMNA
SCHEMBL1154259 0.85 NPC1 (0.53) MAPK14NPC1RAB9AMRGPRX4CASR
SCHEMBL646003 0.84 NPC1 (0.51) MAPK14NPC1RAB9AMRGPRX4LMNA
SCHEMBL1154486 0.84 NPC1 (0.51) MAPK14NPC1RAB9AMRGPRX4LMNA
SCHEMBL1154362 0.81 NPC1 (0.52) NPC1RAB9ADHFRDCPSMRGPRX4
SCHEMBL1154890 0.81 MAPK14 (0.49) MAPK14NPC1RAB9ADHFRDCPS
SCHEMBL1155107 0.81 MRGPRX4 (0.46) MAPK14NPC1RAB9AMRGPRX4LMNA
SCHEMBL1155212 0.81 MAOB (0.49) MAPK14NPC1RAB9AMRGPRX4MAOA

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 10 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-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 (2 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 MAPK14 1389/4885NPC1 4388/4885RAB9A 1250/4885
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy SMN1; SMN2, MUSK, MYO3B MAPK14 1389/4885NPC1 4388/4885RAB9A 1250/4885

“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.