SCHEMBL1618110

SCHEMBL1618110

Cc1sc2cc(Oc3ccnc4cc(O)ccc34)ccc2c1C(=O)NC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.51
KDR P35968 7/20 0.51
AURKA O14965 5/20 0.51
TEK Q02763 5/20 0.51
LCK P06239 3/20 0.51
AURKB Q96GD4 3/20 0.46
ABL1 P00519 2/20 0.46
LYN P07948 1/20 0.46
FGR P09769 1/20 0.46
KIT P10721 3/20 0.46
PDGFRA P16234 3/20 0.46
AXL P30530 2/20 0.43
MAOB P27338 3/20 0.42
RET P07949 4/20 0.41
MAOA P21397 1/20 0.41
ESR1 P03372 2/20 0.39
ESR2 Q92731 1/20 0.39
HDAC1 Q13547 1/20 0.38
RIPK2 O43353 1/20 0.38
ERN1 O75460 1/20 0.38

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
SCHEMBL1617923 0.91 KDR (0.59) METKDRAURKATEKLCK
SCHEMBL1617840 0.90 KDR (0.59) METKDRAURKATEKLCK
SCHEMBL1618169 0.88 KDR (0.64) METKDRAURKATEKLCK
SCHEMBL1618225 0.86 KDR (0.47) METKDRAURKATEKLCK
SCHEMBL1617729 0.84 KDR (0.49) METKDRAURKATEKLCK
SCHEMBL1617635 0.82 AXL (0.43) METKDRAURKATEKLCK
SCHEMBL12716099 0.81 KDR (0.42) METKDRPDGFRB
SCHEMBL1618304 0.81 KDR (0.42) METKDRAURKATEKLCK
SCHEMBL1617951 0.80 KDR (0.45) METKDRAURKATEKLCK
SCHEMBL1618098 0.79 KDR (0.54) METKDRAURKATEKLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381824-B2 Quinoline derivatives AGOURON PHARMACEUTICALS, INC. (US) 2008-06-03 US claimed
JP-2007516273-A 2007-06-21 JP claimed
EP-1699780-A1 NOVEL QUINOLINE DERIVATIVES Pfizer, Inc. (US) 2006-09-13 EP claimed
WO-2005063739-A1 NOVEL QUINOLINE DERIVATIVES PFIZER INC. (US) 2005-07-14 WO claimed
US-20050137395-A1 Novel quinoline derivatives AGOURON PHARMACEUTICALS, INC. 2005-06-23 US claimed
US-7923457-B2 Quinoline derivatives AGOURON PHARMACEUTICALS INC. (US) 2011-04-12 US disclosed
US-7923457-B2 Quinoline derivatives AGOURON PHARMACEUTICALS INC. (US) 2011-04-12 US disclosed
US-7923457-B2 Quinoline derivatives AGOURON PHARMACEUTICALS INC. (US) 2011-04-12 US disclosed
US-20090069316-A1 NOVEL QUINOLINE DERIVATIVES AGOURON PHARMACEUTICALS, INC. 2009-03-12 US disclosed
US-20090069316-A1 NOVEL QUINOLINE DERIVATIVES AGOURON PHARMACEUTICALS, INC. 2009-03-12 US disclosed
US-20090069316-A1 NOVEL QUINOLINE DERIVATIVES AGOURON PHARMACEUTICALS, INC. 2009-03-12 US disclosed
US-7381824-B2 Quinoline derivatives AGOURON PHARMACEUTICALS, INC. (US) 2008-06-03 US disclosed
US-7381824-B2 Quinoline derivatives AGOURON PHARMACEUTICALS, INC. (US) 2008-06-03 US disclosed
US-7381824-B2 Quinoline derivatives AGOURON PHARMACEUTICALS, INC. (US) 2008-06-03 US disclosed
EP-1699780-A1 NOVEL QUINOLINE DERIVATIVES Pfizer, Inc. (US) 2006-09-13 EP disclosed
WO-2005063739-A1 NOVEL QUINOLINE DERIVATIVES PFIZER INC. (US) 2005-07-14 WO disclosed
US-20050137395-A1 Novel quinoline derivatives AGOURON PHARMACEUTICALS, INC. 2005-06-23 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 (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-20090069316-A1 NOVEL QUINOLINE DERIVATIVES COQ8B, COQ8A, MCM5 MET 3942/4885KDR 4516/4885AURKA 2459/4885

“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.