SCHEMBL7577697

SCHEMBL7577697

C#Cc1cccc(Nc2ncnc3cnc(NC4CCN(CC(=O)OC)CC4)cc23)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.59
GAK O14976 3/20 0.49
FBP1 P09467 2/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
ERBB2 P04626 8/20 0.49
RIPK2 O43353 2/20 0.48
BUB1 O43683 2/20 0.48
STK10 O94804 2/20 0.48
ABL1 P00519 2/20 0.48
LCK P06239 2/20 0.48
LYN P07948 2/20 0.48
RET P07949 2/20 0.48
SRC P12931 2/20 0.48
FGFR2 P21802 2/20 0.48
FECH P22830 2/20 0.48
KDR P35968 2/20 0.48
FLT3 P36888 2/20 0.48
MAP3K1 Q13233 2/20 0.48
PLK4 O00444 1/20 0.48

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
SCHEMBL7578731 0.89 EGFR (0.55) EGFRALDH1A1MAPTERBB2KDR
SCHEMBL7585049 0.88 EGFR (0.58) EGFRERBB2ERBB4MKNK1
SCHEMBL7584725 0.88 ERBB2 (0.58) EGFRFBP1ALDH1A1MAPTERBB2
SCHEMBL7843657 0.86 EGFR (0.48) EGFRGAKFBP1ALDH1A1MAPT
SCHEMBL7582363 0.86 EGFR (0.52) EGFRGAKFBP1ALDH1A1MAPT
SCHEMBL7574942 0.85 EGFR (0.51) EGFRGAKFBP1ALDH1A1MAPT
SCHEMBL7585812 0.83 ERBB2 (0.56) EGFRFBP1ALDH1A1MAPTERBB2
SCHEMBL7855902 0.83 EGFR (0.46) EGFRGAKFBP1ALDH1A1MAPT
SCHEMBL7586889 0.83 EGFR (0.49) EGFRGAKFBP1ALDH1A1MAPT
SCHEMBL7855879 0.83 EGFR (0.45) EGFRGAKBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020082420-A1 Bicyclic heterocycles, pharmaceutical compositions containing them, their use, and processes for preparing them BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-06-27 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-20020082420-A1 Bicyclic heterocycles, pharmaceutical compositions containing them, their use, and processes for preparing them PKD1, REN, CYP11B1 EGFR 1041/4885GAK 2237/4885FBP1 1132/4885

“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.