SCHEMBL4814797

SCHEMBL4814797

CN1CCN(Cc2ccc3c(c2)Cc2c(-c4ccc(C=NOCc5ccccc5)s4)n[nH]c2-3)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.61
CHEK1 O14757 1/20 0.54
KCNH2 Q12809 3/20 0.52
FYN P06241 1/20 0.51
CSF1R P07333 1/20 0.51
PDGFRB P09619 1/20 0.51
KIT P10721 1/20 0.51
SRC P12931 1/20 0.51
PDGFRA P16234 1/20 0.51
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51
FLT3 P36888 1/20 0.51
TEK Q02763 1/20 0.51

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
SCHEMBL4814782 1.00 KDR (0.61) KDRCHEK1KCNH2FYNCSF1R
SCHEMBL4816967 0.82 KDR (0.67) KDRCHEK1KCNH2KITFLT1
SCHEMBL4812541 0.81 KDR (0.66) KDRKITFLT1
SCHEMBL4812516 0.81 KDR (0.66) KDRKITFLT1
SCHEMBL4818621 0.80 KDR (0.61) KDRKCNH2KITFLT1
SCHEMBL4818601 0.80 KDR (0.61) KDRKCNH2KITFLT1
SCHEMBL17004680 0.80 KDR (0.56) KDRCHEK1KCNH2KITFLT1
SCHEMBL4818609 0.80 KDR (0.56) KDRCHEK1KCNH2KITFLT1
SCHEMBL4811322 0.78 KDR (0.77) KDRCHEK1KCNH2KITFLT1
SCHEMBL4817603 0.77 KDR (0.64) KDRCHEK1KCNH2KITFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 KDR 666/4885CHEK1 79/4885KCNH2 2628/4885

“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.