SCHEMBL2062996

SCHEMBL2062996

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3)ccnc2cc1OCC1(N(C)C)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.56
PDGFRB P09619 3/20 0.56
PDGFRA P16234 1/20 0.49
FGFR2 P21802 4/20 0.47
AURKB Q96GD4 3/20 0.47
FGFR1 P11362 2/20 0.47
FLT1 P17948 2/20 0.47
FLT4 P35916 2/20 0.47
LYN P07948 2/20 0.47
PDXK O00764 1/20 0.47
RIPK2 O43353 1/20 0.47
RET P07949 1/20 0.47
FGFR3 P22607 1/20 0.47
DDR1 Q08345 1/20 0.47
DDR2 Q16832 1/20 0.47
AURKA O14965 2/20 0.44
LCK P06239 2/20 0.44
MET P08581 2/20 0.44
TEK Q02763 2/20 0.44
EGFR P00533 1/20 0.43

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
SCHEMBL29902480 1.00 KDR (0.56) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL4556432 0.95 KDR (0.64) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL29902462 0.88 KDR (0.71) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL2062492 0.88 KDR (0.71) KDRPDGFRBPDGFRAFGFR2AURKB
Hydrochloric Acid SCHEMBL28914336 0.88 KDR (0.70) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL2063302 0.86 PDGFRB (0.50) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL29902482 0.86 PDGFRB (0.50) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL19056203 0.86 MET (0.49) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL2063822 0.85 KDR (0.53) KDRPDGFRBPDGFRAFGFR2AURKB
SCHEMBL21884829 0.85 PDGFRB (0.57) KDRPDGFRBPDGFRAFGFR2AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125776-B1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES LLC (US) 2017-07-05 EP claimed
US-8148532-B2 Benzyl 1-((4-(1H-indol-5-ylamino)-6-methoxyquinolin-7-yloxy)methyl)cyclopropylcarbamate; cancers associated with protein tyrosine kinases CHEN GUOQING PAUL (US) 2012-04-03 US claimed
EP-2125776-B1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES LLC (US) 2017-07-05 EP disclosed
EP-2125776-B1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES LLC (US) 2017-07-05 EP disclosed
US-8148532-B2 Benzyl 1-((4-(1H-indol-5-ylamino)-6-methoxyquinolin-7-yloxy)methyl)cyclopropylcarbamate; cancers associated with protein tyrosine kinases CHEN GUOQING PAUL (US) 2012-04-03 US disclosed
US-8148532-B2 Benzyl 1-((4-(1H-indol-5-ylamino)-6-methoxyquinolin-7-yloxy)methyl)cyclopropylcarbamate; cancers associated with protein tyrosine kinases CHEN GUOQING PAUL (US) 2012-04-03 US disclosed
US-8148532-B2 Benzyl 1-((4-(1H-indol-5-ylamino)-6-methoxyquinolin-7-yloxy)methyl)cyclopropylcarbamate; cancers associated with protein tyrosine kinases CHEN GUOQING PAUL (US) 2012-04-03 US disclosed
WO-2008112407-A1 SPIRO SUBSTITUTED COMPOUNDS AS ANGIOGENESIS INHIBITORS ADVENCHEN LABORATORIES, LLC (US) 2008-09-18 WO disclosed
US-20080227811-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors ADVENCHEN LABORATORIES, LLC 2008-09-18 US disclosed
US-20080227811-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors ADVENCHEN LABORATORIES, LLC 2008-09-18 US disclosed
US-20080227811-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors ADVENCHEN LABORATORIES, LLC 2008-09-18 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-20080227811-A1 Spiro Substituted Compounds As Angiogenesis Inhibitors TEK, KDR, TIE1 KDR 2/4885PDGFRB 6/4885PDGFRA 8/4885

“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.