SCHEMBL14489801

SCHEMBL14489801

CCOC(=O)N1CCC(Oc2cc3c(Cl)ncnc3cc2OC)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.55
MAPK1 P28482 1/20 0.52
EGFR P00533 16/20 0.52
ERBB2 P04626 7/20 0.52
RIPK2 O43353 1/20 0.49
RET P07949 1/20 0.49
MET P08581 1/20 0.49
EPHB2 P29323 1/20 0.49
TEC P42680 1/20 0.49
EPHB4 P54760 1/20 0.49
EPHA4 P54764 1/20 0.49
BTK Q06187 1/20 0.49
KCNH2 Q12809 1/20 0.49
TNK1 Q13470 1/20 0.49
RIPK3 Q9Y572 1/20 0.49

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
SCHEMBL14489804 0.93 ENPP1 (0.53) ENPP1MAPK1EGFRERBB2RIPK2
SCHEMBL25285854 0.92 ENPP1 (0.51) ENPP1EGFRERBB2RIPK2RET
SCHEMBL14489800 0.91 EGFR (0.58) EGFRERBB2RIPK2RETMET
SCHEMBL14489810 0.91 ERBB2 (0.53) ENPP1MAPK1EGFRERBB2
SCHEMBL14489807 0.88 ENPP1 (0.55) ENPP1EGFRERBB2RIPK2RET
SCHEMBL4087511 0.88 EGFR (0.56) ENPP1EGFRERBB2RIPK2RET
SCHEMBL3129523 0.88 EGFR (0.56) ENPP1EGFRERBB2RIPK2RET
SCHEMBL14489848 0.88 ACHE (0.57) EGFRERBB2RIPK2RETMET
SCHEMBL29465791 0.87 PIK3CD (0.54) EGFRERBB2RIPK2RETMET
SCHEMBL665187 0.87 PIK3CD (0.54) EGFRERBB2RIPK2RETMET

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-20070135463-A1 Bicyclic heterocycles, drugs containing said compounds, the use thereof and method for preparing same HIMMELSBACH FRANK 2007-06-14 US disclosed
US-20070135463-A1 Bicyclic heterocycles, drugs containing said compounds, the use thereof and method for preparing same HIMMELSBACH FRANK 2007-06-14 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-20070135463-A1 Bicyclic heterocycles, drugs containing said compounds, the use thereof and method for preparing same BPHL, CYP11B2, CYP11B1 ENPP1 1955/4885MAPK1 275/4885EGFR 349/4885

“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.