SCHEMBL4815352

SCHEMBL4815352

CC(C)OCCOCC#Cc1cc(-c2n[nH]c3c2Cc2cc(CN4CCN(C)CC4)ccc2-3)cs1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.86
KCNH2 Q12809 13/20 0.86
FYN P06241 2/20 0.77
CSF1R P07333 2/20 0.77
KIT P10721 2/20 0.77
FLT1 P17948 2/20 0.77
FLT4 P35916 2/20 0.77
FLT3 P36888 2/20 0.77
PLK4 O00444 1/20 0.77
CHEK1 O14757 1/20 0.77
IKBKB O14920 1/20 0.77
RPS6KA5 O75582 1/20 0.77
PRKD3 O94806 1/20 0.77
MAP4K4 O95819 1/20 0.77
CHEK2 O96017 1/20 0.77
NTRK1 P04629 1/20 0.77
LCK P06239 1/20 0.77
LYN P07948 1/20 0.77
PIM1 P11309 1/20 0.77
FGFR1 P11362 1/20 0.77

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
SCHEMBL4807866 0.93 KDR (0.85) KDRKCNH2FYNCSF1RKIT
SCHEMBL4816585 0.93 KDR (0.85) KDRKCNH2FYNCSF1RKIT
SCHEMBL4873066 0.92 KDR (0.88) KDRKCNH2FYNCSF1RKIT
SCHEMBL4818932 0.92 KDR (1.00) KDRKCNH2FYNCSF1RKIT
SCHEMBL4807746 0.88 KDR (0.86) KDRKCNH2FYNCSF1RKIT
SCHEMBL4807985 0.88 KDR (0.67) KDRKCNH2FYNCSF1RKIT
SCHEMBL4814383 0.88 KDR (0.87) KDRKCNH2FYNCSF1RKIT
SCHEMBL4818298 0.88 KDR (1.00) KDRKCNH2FYNCSF1RKIT
SCHEMBL4814537 0.88 KDR (0.89) KDRKCNH2FYNCSF1RKIT
SCHEMBL4815705 0.87 KDR (1.00) KDRKCNH2FYNCSF1RKIT

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 5 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 claimed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US claimed
EP-1740579-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2007-01-10 EP claimed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 US claimed
WO-2005095387-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-10-13 WO claimed

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 666/4885KCNH2 2628/4885FYN 202/4885

“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.