SCHEMBL4007152

SCHEMBL4007152

c1nc(Nc2ccc(N3CCOCC3)cc2)c2cc(-c3ccc4ncnc(N5CCOCC5)c4c3)ccc2n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 8/20 0.72
MAPT P10636 2/20 0.72
AHR P35869 1/20 0.72
HTT P42858 1/20 0.72
PI4KB Q9UBF8 1/20 0.67
CLK4 Q9HAZ1 8/20 0.60
CYP3A4 P08684 8/20 0.60
HIF1A Q16665 7/20 0.60
LMNA P02545 7/20 0.60
CYP1A2 P05177 7/20 0.60
ALDH1A1 P00352 5/20 0.60
USP2 O75604 2/20 0.57
TSHR P16473 5/20 0.56
CYP2C19 P33261 5/20 0.56
CYP2D6 P10635 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TTBK1 Q5TCY1 1/20 0.56
TTBK2 Q6IQ55 1/20 0.56
NPC1 O15118 1/20 0.55

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 0.94 MAPT (0.80) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4007596 0.94 MAPK1 (0.64) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4013714 0.94 MAPK1 (0.64) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4009789 0.91 MAPK1 (0.61) MAPK1MAPTAHRHTTPI4KB
SCHEMBL14026142 0.89 MAPK1 (0.72) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4885395 0.86 MAPK1 (0.64) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4886107 0.85 MAPT (0.67) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4013688 0.85 MAPK1 (0.67) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4789541 0.84 MAPT (0.66) MAPK1MAPTAHRHTTPI4KB
SCHEMBL4007243 0.84 CYP1A2 (0.67) MAPK1MAPTAHRHTTPI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844004-B1 QUINAZOLINE DERIVATES AS ANTIVIRAL AGENTS ARROW THERAPEUTICS LTD (GB) 2009-06-24 EP disclosed
US-20080114008-A1 Quinazoline Derivatives as Antiviral Agents ARROW THERAPEUTICS LIMITED (GB) 2008-05-15 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 (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-20080114008-A1 Quinazoline Derivatives as Antiviral Agents IFNAR1, C5, EIF2AK2 MAPK1 3003/4885MAPT 4840/4885AHR 850/4885

“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.