SCHEMBL12411166

SCHEMBL12411166

[C-]#[N+]c1cc2c(Oc3ccc(N)c(F)c3)ccnc2cc1OCC1CCCN(C)C1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.41
EGFR P00533 5/20 0.41
FGFR1 P11362 3/20 0.41
FLT1 P17948 3/20 0.41
FLT4 P35916 3/20 0.41
MET P08581 2/20 0.38
PDPK1 O15530 3/20 0.37
PDGFRA P16234 3/20 0.37
KIT P10721 1/20 0.37
FGFR2 P21802 1/20 0.37
ROCK2 O75116 1/20 0.37
ROCK1 Q13464 1/20 0.37
CDC42BPB Q9Y5S2 1/20 0.37
PDGFRB P09619 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
BTK Q06187 1/20 0.36

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
SCHEMBL12410973 0.90 KDR (0.41) KDREGFRFGFR1FLT1FLT4
SCHEMBL1896179 0.86 IRAK4 (0.42) KDREGFRFGFR1FLT1FLT4
SCHEMBL12411641 0.82 KDR (0.55) KDRFLT1FLT4METPDGFRA
SCHEMBL12411142 0.82 GPR119 (0.42) METIRAK4BTK
SCHEMBL12411144 0.81 FLT3 (0.39) KDRMETPDGFRAKITFGFR2
SCHEMBL12411121 0.81 FLT3 (0.39) KDRMETPDGFRAKITFGFR2
SCHEMBL12412231 0.81 KDR (0.48) KDREGFRFGFR1FLT1FLT4
SCHEMBL12411211 0.81 EHMT2 (0.49) KDREGFRMETKITFGFR2
SCHEMBL12410622 0.81 PDGFRA (0.53) KDREGFRPDGFRAKITFGFR2
SCHEMBL12411209 0.80 FGFR2 (0.50) KDREGFRMETKITFGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372981-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-12 US disclosed
US-7973160-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-07-05 US disclosed
US-20110118470-A1 NITROGEN-CONTAINING AROMATIC DERIVATIVES FUNAHASHI YASUHIRO 2011-05-19 US disclosed
US-20100197911-A1 Nitrogen-Containing Aromatic Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-05 US disclosed
US-7612092-B2 Urea derivatives containing aromatic or heteroaromatic rings; 4-(3-chloro-4-(cyclopropylaminocarbonyl)aminophenoxy)-7-methoxy-6-quinolinecarboxamide; prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed
US-7253286-B2 Urea derivatives containing aromatic or heteroaromatic rings, useful as prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI CO., LTD (JP) 2007-08-07 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 (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-20100197911-A1 Nitrogen-Containing Aromatic Derivatives GNG2, GCG, FRG1 KDR 2687/4885EGFR 790/4885FGFR1 499/4885
US-20110118470-A1 NITROGEN-CONTAINING AROMATIC DERIVATIVES GNG2, GCG, FRG1 KDR 2782/4885EGFR 795/4885FGFR1 573/4885

“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.