SCHEMBL166204

SCHEMBL166204

COc1cc2c(Oc3ccc([N+](=O)[O-])cc3F)ccnc2cc1OCCCNC(=O)OC(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AXL P30530 8/20 0.67
MET P08581 4/20 0.51
FGFR2 P21802 2/20 0.51
PDGFRA P16234 1/20 0.49
KDR P35968 1/20 0.49
FLT3 P36888 4/20 0.48

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
Methane SCHEMBL25425302 0.88 AXL (0.56) AXLMETFGFR2PDGFRAKDR
SCHEMBL167217 0.87 AXL (0.70) AXLMETFGFR2FLT3
SCHEMBL29168459 0.84 MET (0.55) AXLMETPDGFRAKDRFLT3
SCHEMBL12635542 0.83 MET (0.53) AXLMETFGFR2PDGFRAKDR
SCHEMBL20032555 0.83 PDGFRA (0.53) AXLMETFGFR2PDGFRAKDR
SCHEMBL14310929 0.83 MET (0.55) AXLMETFGFR2PDGFRAKDR
SCHEMBL20032550 0.82 KDR (0.52) AXLMETFGFR2PDGFRAKDR
SCHEMBL31554535 0.82 FLT3 (0.54) AXLMETFGFR2PDGFRAKDR
SCHEMBL29487188 0.82 PDGFRA (0.59) AXLMETFGFR2PDGFRAKDR
SCHEMBL174159 0.82 PDGFRA (0.59) AXLMETFGFR2PDGFRAKDR

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-8999982-B2 Pharmaceutically active compounds as Axl inhibitors LEAD DISCOVERY CENTER GMBH (DE) 2015-04-07 US disclosed
EP-2609091-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2014-11-26 EP disclosed
US-20140018365-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WISSENSCCHAFTEN E.V. (DE) 2014-01-16 US disclosed
EP-2609091-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS Lead Discovery Center GmbH (DE) 2013-07-03 EP disclosed
WO-2012028332-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2012-03-08 WO disclosed
EP-2423208-A1 Pharmaceutically active compounds as Axl inhibitors Lead Discovery Center GmbH (DE) 2012-02-29 EP 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-20140018365-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS AXL, FLT3, ERBB3 AXL 1/4885MET 8/4885FGFR2 88/4885

“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.