SCHEMBL4419740

SCHEMBL4419740

O=C(O)C=Cc1cc2ncnc(NC(=O)Nc3c(Cl)cccc3Cl)c2s1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.38
FGFR1 P11362 3/20 0.38
NPSR1 Q6W5P4 1/20 0.37
TYK2 P29597 6/20 0.36
ADORA3 P0DMS8 1/20 0.36
FLT1 P17948 2/20 0.36
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
JAK2 O60674 2/20 0.34

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
SCHEMBL4419732 1.00 EGFR (0.38) EGFRFGFR1NPSR1TYK2ADORA3
Hydrochloric Acid SCHEMBL4432013 0.99 EGFR (0.37) EGFRFGFR1NPSR1TYK2ADORA3
Hydrochloric Acid SCHEMBL4432011 0.99 EGFR (0.37) EGFRFGFR1NPSR1TYK2ADORA3
SCHEMBL6781682 0.90 AURKA (0.44) EGFRNPSR1MEN1KMT2AMAPT
SCHEMBL6771123 0.81 EGFR (0.45) EGFRFGFR1
SCHEMBL6771114 0.81 EGFR (0.45) EGFRFGFR1
SCHEMBL6781420 0.80 EGFR (0.43) EGFR
SCHEMBL4429439 0.75 AURKA (0.51) EGFRNPSR1
SCHEMBL4417586 0.70 IKBKB (0.46) NPSR1KMT2A
SCHEMBL4417588 0.70 IKBKB (0.46) NPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498335-B2 Method of producing an antiangiogenic or vascular permeability reducing effect ASTRAZENECA AB (CH) 2009-03-03 US disclosed
EP-1218353-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LTD (GB) 2007-10-17 EP disclosed
EP-1272185-B1 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-07-27 EP disclosed
US-6806274-B1 IMMUNOREGULATION OR IMMUNOSUPPRESSIVE AGENTS; TYROSINE KINASE INHIBITORS; PREVENTING ORGAN TRANSPLANT REJECTION; AUTOIMMUNE CONDITIONS; REDUCED SIDE EFFECTS ASTRAZENECA UK LIMITED (GB) 2004-10-19 US disclosed
US-20030225111-A1 Therapy ASTRAZENECA AB (SE) 2003-12-04 US disclosed
EP-1218353-A1 QUINAZOLINE DERIVATIVES AstraZeneca UK Limited (GB) 2002-07-03 EP disclosed
WO-2001004102-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-01-18 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-20030225111-A1 Therapy VEGFA, AQP1, FLT1 EGFR 1578/4885FGFR1 474/4885NPSR1 1407/4885

“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.