SCHEMBL6872508

SCHEMBL6872508

Nc1ncnc2c1c(-c1ccc(OCc3ccccc3)cc1)cn2C1CCOC1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 10/20 0.79
LCK P06239 8/20 0.79
TEK Q02763 6/20 0.79
KDR P35968 4/20 0.73
BTK Q06187 4/20 0.73
FYN P06241 2/20 0.73
FLT3 P36888 2/20 0.73
AURKB Q96GD4 2/20 0.73
RET P07949 2/20 0.73
MAP2K2 P36507 2/20 0.73
MAP2K1 Q02750 2/20 0.73
ACVR1 Q04771 2/20 0.73
PDGFRB P09619 1/20 0.73
PDGFRA P16234 1/20 0.73
FLT1 P17948 1/20 0.73
LTK P29376 1/20 0.73
CDK8 P49336 1/20 0.73
TNK2 Q07912 1/20 0.73
IKBKE Q14164 1/20 0.73
NTRK3 Q16288 1/20 0.73

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
SCHEMBL6865566 0.94 SRC (0.79) SRCLCKTEKKDRBTK
SCHEMBL6461041 0.89 LCK (1.00) SRCLCKTEKKDRBTK
SCHEMBL6465414 0.85 IGF1R (0.63) SRCLCKTEKKDRBTK
SCHEMBL6861271 0.84 IGF1R (0.67) SRCLCKTEKKDRBTK
SCHEMBL6868903 0.83 SRC (0.73) SRCLCKTEKKDRBTK
SCHEMBL20351598 0.83 SRC (0.76) SRCLCKTEKKDRBTK
Hydrochloric Acid SCHEMBL8108614 0.83 SRC (0.78) SRCLCKTEKKDRBTK
SCHEMBL6466052 0.82 LCK (1.00) SRCLCKTEKKDRBTK
SCHEMBL6461225 0.82 LCK (0.84) SRCLCKTEKKDRBTK
SCHEMBL6461152 0.81 SRC (0.80) SRCLCKTEKKDRBTK

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-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 US disclosed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 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-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI SRC 206/4885LCK 6/4885TEK 22/4885

“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.