SCHEMBL2099249

SCHEMBL2099249

COC(=O)C1(COc2cc3nccc(Oc4ccc(N)cc4F)c3cc2OC)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AXL P30530 9/20 0.57
MET P08581 10/20 0.55
KDR P35968 4/20 0.55
PDGFRB P09619 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
RET P07949 1/20 0.50
KIT P10721 1/20 0.50
FLT3 P36888 1/20 0.50
PDGFRA P16234 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
MERTK Q12866 1/20 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
SCHEMBL456691 0.86 MET (0.52) AXLMETKDRPDGFRBHDAC2
SCHEMBL166914 0.82 AXL (0.67) AXLMETKDRPDGFRBKIT
Hydrochloric Acid SCHEMBL21776567 0.81 AXL (0.66) AXLMETKDRPDGFRBKIT
Hydrochloric Acid SCHEMBL30388215 0.81 AXL (0.66) AXLMETKDRPDGFRBKIT
SCHEMBL17035605 0.81 AXL (0.66) AXLMETKDRPDGFRBKIT
SCHEMBL29168479 0.81 AXL (0.64) AXLMETKDRPDGFRBHDAC2
SCHEMBL2063349 0.80 KDR (0.75) AXLMETKDRPDGFRBHDAC2
SCHEMBL17035604 0.80 AXL (0.64) AXLMETKDRPDGFRBKIT
SCHEMBL20032554 0.80 AXL (0.68) AXLMETKDRPDGFRBFLT3
SCHEMBL2101280 0.80 KDR (0.62) AXLMETKDRPDGFRBRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513283-B2 Spiro substituted compounds as angiogenesis inhibitors ADVENCHEN LABORATORIES, LLC (US) 2013-08-20 US disclosed
EP-2125777-B1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LAB LLC (US) 2013-04-10 EP disclosed
US-20120165371-A1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES, LLC (US) 2012-06-28 US disclosed
US-8163923-B2 Benzyl 1-((6-methoxy-4-(5-(methylcarbamoyl)naphthalen-2-yloxy)quinolin-7-yloxy)methyl)cyclo-propylcarbamate; cancers associated with protein tyrosine kinases ADVENCHEN LABORATORIES, LLC (US) 2012-04-24 US disclosed
EP-2125777-A1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS Advenchen Laboratories, LLC (US) 2009-12-02 EP disclosed
US-20080227812-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors ADVENCHEN LABORATORIES, LLC 2008-09-18 US disclosed
WO-2008112408-A1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES, LLC (US) 2008-09-18 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-20120165371-A1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS TEK, KDR, TIE1 AXL 65/4885MET 176/4885KDR 2/4885
US-20080227812-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors TEK, KDR, TIE1 AXL 65/4885MET 176/4885KDR 2/4885

“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.