SCHEMBL1887966

SCHEMBL1887966

COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCCCN(C)S(C)(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.71
EGFR P00533 15/20 0.71
RET P07949 2/20 0.69
KIF5B P33176 2/20 0.69
FGFR1 P11362 12/20 0.63
FLT1 P17948 12/20 0.63
FLT4 P35916 11/20 0.63
PDGFRB P09619 3/20 0.62
FGFR2 P21802 2/20 0.62
FGFR4 P22455 2/20 0.62
FGFR3 P22607 2/20 0.62
TEK Q02763 2/20 0.57
BMPR1B O00238 1/20 0.57
PLK4 O00444 1/20 0.57
CIT O14578 1/20 0.57
GAK O14976 1/20 0.57
EPHB6 O15197 1/20 0.57
RIPK2 O43353 1/20 0.57
ROCK2 O75116 1/20 0.57
STK10 O94804 1/20 0.57

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
Hydrochloric Acid SCHEMBL6489998 0.99 KDR (0.70) KDREGFRRETKIF5BFGFR1
SCHEMBL1887242 0.91 FLT1 (0.71) KDREGFRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL1885543 0.90 FLT1 (0.70) KDREGFRFGFR1FLT1FLT4
SCHEMBL17520351 0.89 KDR (0.78) KDREGFRRETKIF5BFGFR1
SCHEMBL1467073 0.88 KDR (0.74) KDREGFRRETKIF5BFGFR1
SCHEMBL17520325 0.87 KDR (0.77) KDREGFRRETKIF5BFGFR1
SCHEMBL1468281 0.84 KDR (0.82) KDREGFRRETKIF5BFGFR1
SCHEMBL14964748 0.84 KDR (0.82) KDREGFRRETKIF5BFGFR1
SCHEMBL6100586 0.84 TRPA1 (0.53) KDREGFRRETKIF5BFGFR1
SCHEMBL4109645 0.84 KDR (0.80) KDREGFRRETKIF5BFGFR1

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 13 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 claimed
JP-3438818-B2 2003-08-18 JP claimed
US-6414148-B1 PRODUCE ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT IN WARM-BLOODED ANIMALS ZENECA LIMITED (GB) 2002-07-02 US claimed
JP-2001500891-A 2001-01-23 JP claimed
EP-0929530-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1999-07-21 EP claimed
WO-1998013354-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1998-04-02 WO claimed
US-RE42353-E1 Quinazoline derivatives and pharmaceutical compositions containing them ASTRAZENECA UK LIMITED (GB) 2011-05-10 US disclosed
US-20050239777-A1 Quinazoline derivatives and pharmaceutical compositions containing them ZENECA PHARMA S.A. (FR) 2005-10-27 US disclosed
US-6897210-B2 Quinazoline derivatives and pharmaceutical compositions containing them ZENECA LIMITED (GB) 2005-05-24 US disclosed
US-20040242574-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED 2004-12-02 US disclosed
US-6414148-B1 PRODUCE ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT IN WARM-BLOODED ANIMALS ZENECA LIMITED (GB) 2002-07-02 US disclosed
EP-0929530-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1999-07-21 EP disclosed
WO-1998013354-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1998-04-02 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 (2 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 6/4885EGFR 203/4885RET 859/4885
US-20050239777-A1 Quinazoline derivatives and pharmaceutical compositions containing them NR5A1, NR5A2, CNKSR1 KDR 13/4885EGFR 138/4885RET 425/4885

“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.