SCHEMBL6478330

SCHEMBL6478330

Nc1c(Cl)ccc2occc12

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.38
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
FTO Q9C0B1 1/20 0.38
NFKB1 P19838 1/20 0.36
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
HTR2B P41595 1/20 0.34
PAX8 Q06710 1/20 0.33
FADS1 O60427 1/20 0.32
ACHE P22303 1/20 0.32
CDK9 P50750 1/20 0.32
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL8799124 0.77 MAOA (0.40) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL10449393 0.77 MAOA (0.42) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL16762286 0.74 MAOA (0.36) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL6949814 0.74 MAOA (0.38) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL6921642 0.74 MAOA (0.38) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL4429415 0.72 PAX8 (0.48) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL2359630 0.72 TSHR (0.47) CYP3A4TSHR
SCHEMBL4415644 0.72 CYP3A4 (0.42) DYRK1AMAOAMAOBFTONFKB1
SCHEMBL31238945 0.70 TSHR (0.41) CYP3A4TSHR
SCHEMBL11880529 0.70 TSHR (0.41) CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6939866-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2005-09-06 US disclosed
US-20040044015-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-03-04 US disclosed
EP-1326860-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-07-16 EP disclosed
WO-2002030926-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-04-18 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-20040044015-A1 Quinazoline derivatives NQO2, NRAS, TOP1 DYRK1A 2344/4885MAOA 1001/4885MAOB 881/4885

“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.