SCHEMBL4889115

SCHEMBL4889115

c1csc(-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.66
HTT P42858 3/20 0.66
MAPK1 P28482 1/20 0.66
AHR P35869 1/20 0.66
PI4KB Q9UBF8 1/20 0.62
RIPK2 O43353 1/20 0.60
RIPK3 Q9Y572 1/20 0.60
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
POLB P06746 1/20 0.58
TTBK1 Q5TCY1 1/20 0.51
TTBK2 Q6IQ55 1/20 0.51
CD38 P28907 7/20 0.51
PRKDC P78527 2/20 0.48
EIF2AK2 P19525 1/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPKAPK2 P49137 1/20 0.48
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL4008515 0.87 MAPT (0.80) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4890249 0.87 CD38 (0.49) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4888359 0.87 RIPK2 (0.57) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4889676 0.85 MAPK1 (0.48) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4890852 0.85 EGFR (0.55) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4895102 0.84 MAPT (0.63) MAPTHTTMAPK1AHRPI4KB
SCHEMBL14026142 0.84 MAPK1 (0.72) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4892850 0.84 MAPT (0.66) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4007152 0.82 MAPK1 (0.72) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4890693 0.81 PI4KB (0.68) MAPTHTTMAPK1AHRPI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080311076-A1 Morpholinylanilinoquinazoline Derivatives For Use As Antiviral Agents ARROW THERAPEUTICS LIMITED (GB) 2008-12-18 US disclosed
EP-1748991-A1 MORPHOLINYLANILINOQUINAZO- LINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS Arrow Therapeutics Limited (GB) 2007-02-07 EP disclosed
WO-2005105761-A1 MORPHOLINYLANILINOQUINAZO- LINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS ARROW THERAPEUTICS LIMITED (GB) 2005-11-10 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-20080311076-A1 Morpholinylanilinoquinazoline Derivatives For Use As Antiviral Agents EIF2AK2, MAVS, IRF3 MAPT 2064/4885HTT 3581/4885MAPK1 1945/4885

“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.