SCHEMBL13314404

SCHEMBL13314404

NCC1CC(n2cc(-c3ccc4occc4c3)c3c(N)ncnc32)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 12/20 0.57
ABL1 P00519 10/20 0.57
SRC P12931 9/20 0.57
KDR P35968 6/20 0.57
INSR P06213 5/20 0.57
LCK P06239 5/20 0.57
KIT P10721 5/20 0.57
RET P07949 4/20 0.57
PDGFRA P16234 4/20 0.57
FGFR4 P22455 4/20 0.57
LYN P07948 4/20 0.57
FGFR1 P11362 4/20 0.57
FLT1 P17948 4/20 0.57
FLT3 P36888 4/20 0.57
JAK2 O60674 3/20 0.57
FGFR3 P22607 3/20 0.57
ALK Q9UM73 3/20 0.57
CSF1R P07333 3/20 0.57
MET P08581 3/20 0.57
PDGFRB P09619 3/20 0.57

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
SCHEMBL13314412 0.93 IGF1R (0.56) IGF1RABL1SRCKDRINSR
SCHEMBL13314413 0.83 SRC (0.54) IGF1RABL1SRCKDRINSR
SCHEMBL13314405 0.83 IGF1R (0.61) IGF1RABL1SRCKDRINSR
SCHEMBL13314339 0.83 IGF1R (0.68) IGF1RABL1SRCKDRINSR
SCHEMBL13314318 0.82 ABL1 (0.61) IGF1RABL1SRCKDRINSR
SCHEMBL13314317 0.82 EGFR (0.74) IGF1RABL1SRCKDRINSR
SCHEMBL13314316 0.82 SRC (0.54) IGF1RABL1SRCKDRINSR
SCHEMBL13314417 0.82 ABL1 (0.56) IGF1RABL1SRCKDRINSR
SCHEMBL13314360 0.81 SRC (0.55) IGF1RABL1SRCKDRINSR
SCHEMBL13314393 0.81 RIPK2 (0.63) IGF1RABL1SRCKDRINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160356-A1 NOVEL CYCLOBUTYL COMPOUNDS AS KINASE INHIBITORS MERCK PATENT GESELLSCHAFT (DE) 2010-06-24 US disclosed
US-20100160356-A1 NOVEL CYCLOBUTYL COMPOUNDS AS KINASE INHIBITORS MERCK PATENT GESELLSCHAFT (DE) 2010-06-24 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-20100160356-A1 NOVEL CYCLOBUTYL COMPOUNDS AS KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K2 IGF1R 645/4885ABL1 180/4885SRC 266/4885

“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.