SCHEMBL4465890

SCHEMBL4465890

CCOC(=O)c1cncc(-c2cnn3cc(-c4ccc(OC)cc4)cnc23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.60
BMP4 P12644 5/20 0.58
FLT1 P17948 3/20 0.58
FLT4 P35916 3/20 0.58
BMPR1B O00238 3/20 0.53
BMPR1A P36894 3/20 0.53
ACVRL1 P37023 3/20 0.53
ACVR1 Q04771 3/20 0.53
TGFBR2 P37173 2/20 0.53
PRKAB1 Q9Y478 2/20 0.53
BMPR2 Q13873 1/20 0.53
KMT2A Q03164 1/20 0.51
PLK4 O00444 1/20 0.48
AURKA O14965 1/20 0.48
DYRK3 O43781 1/20 0.48
MAP4K4 O95819 1/20 0.48
NTRK1 P04629 1/20 0.48
INSR P06213 1/20 0.48
CDK1 P06493 1/20 0.48
FGFR1 P11362 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
SCHEMBL13818131 0.89 KDR (0.52) KDRBMP4FLT1FLT4MAOB
SCHEMBL4479049 0.86 KDR (0.59) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL4477345 0.84 KDR (0.62) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL4477974 0.84 KDR (0.57) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL640295 0.81 CYP11B1 (0.60) KMT2AMAP4K4MKNK2MAOB
SCHEMBL4469276 0.80 KDR (0.57) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL4477194 0.80 PDE2A (0.57) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL13126019 0.77 KDR (0.76) KDRBMP4FLT1FLT4BMPR1B
SCHEMBL4479183 0.76 KDR (0.58) KDRBMP4FLT1FLT4KMT2A
SCHEMBL7610653 0.76 KDR (1.00) KDRBMP4FLT1FLT4BMPR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550470-B2 Substituted pyrazolo[1,5-A]pyrimidines as tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 US claimed
US-20060025426-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-02-02 US claimed
WO-2004052315-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2004-06-24 WO claimed
US-7550470-B2 Substituted pyrazolo[1,5-A]pyrimidines as tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 US disclosed
US-7550470-B2 Substituted pyrazolo[1,5-A]pyrimidines as tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 US disclosed
US-7550470-B2 Substituted pyrazolo[1,5-A]pyrimidines as tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 US disclosed
US-20060025426-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-02-02 US disclosed
WO-2004052315-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2004-06-24 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 (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-20060025426-A1 Tyrosine kinase inhibitors FLT1, FLT4, KDR KDR 3/4885BMP4 2059/4885FLT1 1/4885

“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.