SCHEMBL1467971

SCHEMBL1467971

COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCC(=O)N1CCN(C)CC1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.76
FLT1 P17948 19/20 0.76
FGFR1 P11362 18/20 0.76
FLT4 P35916 13/20 0.76
EGFR P00533 11/20 0.76
EPHB2 P29323 1/20 0.64
FGFR2 P21802 1/20 0.63
FGFR4 P22455 1/20 0.63
FGFR3 P22607 1/20 0.63
AURKA O14965 1/20 0.61
PDGFRB P09619 1/20 0.61
TEK Q02763 1/20 0.61
AURKB Q96GD4 1/20 0.61

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
SCHEMBL1470061 0.94 KDR (0.74) KDRFLT1FGFR1FLT4EGFR
SCHEMBL1467152 0.92 KDR (0.76) KDRFLT1FGFR1FLT4EGFR
SCHEMBL7867152 0.87 KDR (0.98) KDRFLT1FGFR1FLT4EGFR
Hydrochloric Acid SCHEMBL7864665 0.86 KDR (1.00) KDRFLT1FGFR1FLT4EGFR
SCHEMBL7864669 0.86 KDR (1.00) KDRFLT1FGFR1FLT4EGFR
SCHEMBL1470093 0.86 KDR (0.76) KDRFLT1FGFR1FLT4EGFR
Hydrochloric Acid SCHEMBL1468019 0.84 FLT1 (0.81) KDRFLT1FGFR1FLT4EGFR
SCHEMBL1467998 0.83 KDR (0.90) KDRFLT1FGFR1FLT4EGFR
SCHEMBL1468389 0.83 KDR (0.71) KDRFLT1FGFR1FLT4EGFR
SCHEMBL1468087 0.83 FGFR1 (0.98) KDRFLT1FGFR1FLT4EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE42353-E1 Quinazoline derivatives and pharmaceutical compositions containing them ASTRAZENECA UK LIMITED (GB) 2011-05-10 US disclosed
US-20110071144-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 2011-03-24 US disclosed
US-20050239777-A1 Quinazoline derivatives and pharmaceutical compositions containing them ZENECA PHARMA S.A. (FR) 2005-10-27 US disclosed
US-20040242574-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED 2004-12-02 US disclosed
US-6673803-B2 FOR TREATMENT OF A NUMBER OF DISEASE STATES INCLUDING CANCER AND RHEUMATOID ARTHRITIS; ACTIVITY AGAINST EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE ZENECA LIMITED (GB) 2004-01-06 US disclosed
US-20020173646-A1 Quinazoline derivatives and pharmaceutical compositions containing them ZENECA LIMITED 2002-11-21 US disclosed
EP-0929530-B1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2002-11-20 EP disclosed
US-6414148-B1 PRODUCE ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT IN WARM-BLOODED ANIMALS ZENECA LIMITED (GB) 2002-07-02 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 (4 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-20040242574-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CNKSR1, FLT1, NR5A1 KDR 6/4885FLT1 2/4885FGFR1 177/4885
US-20020173646-A1 Quinazoline derivatives and pharmaceutical compositions containing them CNKSR1, FLT1, VEGFA KDR 4/4885FLT1 2/4885FGFR1 195/4885
US-20110071144-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NR5A1, NR5A2, CNKSR1 KDR 13/4885FLT1 8/4885FGFR1 146/4885
US-20050239777-A1 Quinazoline derivatives and pharmaceutical compositions containing them NR5A1, NR5A2, CNKSR1 KDR 13/4885FLT1 8/4885FGFR1 146/4885

“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.