SCHEMBL6867601

SCHEMBL6867601

Nc1ncnc2c1c(-c1ccc(O)cc1)cn2C1CCOCC1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 15/20 0.80
ABL1 P00519 8/20 0.80
EGFR P00533 8/20 0.80
ABL2 P42684 8/20 0.80
RIPK2 O43353 4/20 0.77
LCK P06239 4/20 0.72
TEK Q02763 2/20 0.72
HCK P08631 1/20 0.72
RET P07949 2/20 0.63
PDGFRB P09619 2/20 0.63
PDGFRA P16234 2/20 0.63
FLT1 P17948 2/20 0.63
KDR P35968 2/20 0.63
FLT3 P36888 2/20 0.63
NTRK3 Q16288 2/20 0.63
NTRK2 Q16620 2/20 0.63
FYN P06241 1/20 0.63
LTK P29376 1/20 0.63
MAP2K2 P36507 1/20 0.63
CDK8 P49336 1/20 0.63

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
SCHEMBL6868903 0.93 SRC (0.73) SRCABL1EGFRABL2RIPK2
SCHEMBL20351800 0.91 SRC (0.74) SRCABL1EGFRABL2RIPK2
SCHEMBL8108273 0.88 SRC (0.70) SRCABL1EGFRABL2RIPK2
SCHEMBL7020106 0.86 SRC (0.87) SRCABL1EGFRABL2RIPK2
SCHEMBL8098913 0.84 SRC (0.63) SRCABL1EGFRABL2RIPK2
SCHEMBL20351598 0.84 SRC (0.76) SRCABL1EGFRABL2RIPK2
SCHEMBL6466052 0.84 LCK (1.00) SRCABL1EGFRLCKTEK
SCHEMBL6865566 0.82 SRC (0.79) SRCABL1EGFRABL2RIPK2
SCHEMBL8107249 0.82 SRC (0.80) SRCABL1EGFRABL2RIPK2
SCHEMBL7019904 0.82 SRC (1.00) SRCABL1EGFRABL2RIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 US disclosed
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 US disclosed
WO-2015077866-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE INC. (CA) 2015-06-04 WO disclosed
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
EP-1114053-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017203-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO 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 (2 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 206/4885ABL1 78/4885EGFR 457/4885
US-20170158697-A1 Protein Kinase Inhibitors TEC, LCK, SRC SRC 3/4885ABL1 27/4885EGFR 675/4885

“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.