SCHEMBL20127269

SCHEMBL20127269

C#Cc1cccc(Nc2ncnc3cc(OCCOC)c(N)cc23)c1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.85
ERBB2 P04626 5/20 0.85
GAK O14976 4/20 0.85
ILK Q13418 3/20 0.85
RIPK2 O43353 2/20 0.85
BUB1 O43683 2/20 0.85
STK10 O94804 2/20 0.85
ABL1 P00519 2/20 0.85
LCK P06239 2/20 0.85
LYN P07948 2/20 0.85
RET P07949 2/20 0.85
SRC P12931 2/20 0.85
FGFR2 P21802 2/20 0.85
FECH P22830 2/20 0.85
KDR P35968 2/20 0.85
FLT3 P36888 2/20 0.85
MAP3K1 Q13233 2/20 0.85
PLK4 O00444 1/20 0.85
CIT O14578 1/20 0.85
AURKA O14965 1/20 0.85

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
Erlotinib SCHEMBL30362833 0.92 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL3667407 0.92 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL29351329 0.92 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL8413 0.92 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL16767632 0.91 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL21176918 0.91 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL29460839 0.91 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL18563 0.91 EGFR (1.00) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL417841 0.91 EGFR (0.98) EGFRERBB2GAKILKRIPK2
Erlotinib SCHEMBL1959332 0.91 EGFR (0.98) EGFRERBB2GAKILKRIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190169134-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT RENOTARGET THERAPEUTICS INC. 2019-06-06 US disclosed
US-10202357-B2 Class of quinolone heterocyclic aromatic molecules for cancer treatment RenoTarget Therapeutics, Inc. (US) 2019-02-12 US disclosed
WO-2018089269-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT RENOTARGET THERAPEUTICS INC. (US) 2018-05-17 WO disclosed
US-20180127383-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT RENOTARGET THERAPEUTICS INC. 2018-05-10 US disclosed
US-20180127383-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT RENOTARGET THERAPEUTICS INC. 2018-05-10 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 (3 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-10202357-B2 Class of quinolone heterocyclic aromatic molecules for cancer treatment EGFR, ABL1, NRAS EGFR 1/4885ERBB2 4/4885GAK 540/4885
US-20180127383-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT EGFR, NRAS, ABL1 EGFR 1/4885ERBB2 5/4885GAK 566/4885
US-20190169134-A1 NOVEL CLASS OF QUINOLONE HETEROCYCLIC AROMATIC MOLECULES FOR CANCER TREATMENT EGFR, NRAS, HRAS EGFR 1/4885ERBB2 8/4885GAK 554/4885

“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.