SCHEMBL2071961

SCHEMBL2071961

CC(=O)c1cc(F)ccc1Oc1ccc(-c2cn(C(C)C)c3ncnc(N)c23)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.71
TEK Q02763 14/20 0.71
LCK P06239 11/20 0.71
SRC P12931 2/20 0.61
PIK3CD O00329 1/20 0.49
PIK3CA P42336 1/20 0.49
PIK3CB P42338 1/20 0.49
PIK3CG P48736 1/20 0.49
PRKDC P78527 1/20 0.49
FLT3 P36888 1/20 0.46
MET P08581 2/20 0.46
AXL P30530 2/20 0.46
RIPK1 Q13546 1/20 0.43
NTRK1 P04629 1/20 0.43
NTRK3 Q16288 1/20 0.43
NTRK2 Q16620 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
SCHEMBL2072501 0.90 KDR (0.70) KDRTEKLCKSRCPIK3CD
SCHEMBL2074526 0.89 TEK (0.86) KDRTEKLCKSRCPIK3CD
SCHEMBL2073174 0.89 KDR (0.66) KDRTEKLCKSRCPIK3CD
SCHEMBL2073069 0.86 KDR (0.66) KDRTEKLCKSRCPIK3CD
SCHEMBL2073353 0.85 TEK (0.67) KDRTEKLCKSRCPIK3CD
SCHEMBL2073312 0.85 KDR (0.67) KDRTEKLCKSRCPIK3CD
SCHEMBL2074864 0.84 KDR (0.67) KDRTEKLCKSRCPIK3CD
SCHEMBL2073350 0.84 TEK (0.71) KDRTEKLCKSRCPIK3CD
SCHEMBL2074635 0.83 KDR (0.63) KDRTEKLCKSRCPIK3CD
SCHEMBL2071944 0.83 KDR (0.80) KDRTEKLCKSRCPIK3CD

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
US-7863444-B2 4-aminopyrrolopyrimidines as kinase inhibitors ABBOTT LABORATORIES (US) 2011-01-04 US disclosed
WO-2004100868-A2 METHOD OF TREATING TRANSPLANT REJECTION ABBOTT LABORATORIES (US) 2004-11-25 WO disclosed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 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-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 KDR 140/4885TEK 199/4885LCK 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.