SCHEMBL4348479

SCHEMBL4348479

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

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.85
ERBB2 P04626 7/20 0.85
GAK O14976 3/20 0.85
FLT1 P17948 2/20 0.85
ILK Q13418 2/20 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

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
SCHEMBL30052378 1.00 EGFR (0.85) EGFRERBB2GAKFLT1ILK
Hydrochloric Acid SCHEMBL1507512 0.99 EGFR (0.85) EGFRERBB2GAKFLT1ILK
SCHEMBL1507585 0.96 EGFR (0.85) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL29120903 0.92 EGFR (0.96) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL3667407 0.92 EGFR (1.00) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL29351329 0.92 EGFR (1.00) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL8413 0.92 EGFR (1.00) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL30362833 0.92 EGFR (1.00) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL28471753 0.91 EGFR (0.94) EGFRERBB2GAKFLT1ILK
Erlotinib SCHEMBL1959332 0.91 EGFR (0.98) EGFRERBB2GAKFLT1ILK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111265668-A Composition comprising a histamine release-promoting substance and an inhibitory compound 黄泳华 2020-06-12 CN claimed
US-5747498-A Alkynyl and azido-substituted 4-anilinoquinazolines PFIZER INC. (US) 1998-05-05 US claimed
US-20230122540-A1 SYSTEMS AND METHODS TO TRACK THE EVOLUTION OF SINGLE CELLS GENENTECH INC (US) 2023-04-20 US disclosed
US-20230122540-A1 SYSTEMS AND METHODS TO TRACK THE EVOLUTION OF SINGLE CELLS GENENTECH INC (US) 2023-04-20 US disclosed
EP-4121526-A1 SYSTEMS AND METHODS TO TRACK THE EVOLUTION OF SINGLE CELLS GENENTECH, INC. (US) 2023-01-25 EP disclosed
CN-115298309-A System and method for tracking single cell evolution 基因泰克公司 2022-11-04 CN disclosed
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof GENENTECH, INC. (US) 2022-02-08 US disclosed
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof GENENTECH, INC. (US) 2022-02-08 US disclosed
US-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2021-10-07 US disclosed
US-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2021-10-07 US disclosed
WO-2021188973-A1 SYSTEMS AND METHODS TO TRACK THE EVOLUTION OF SINGLE CELLS GENENTECH, INC. (US) 2021-09-23 WO disclosed
WO-2021188973-A1 SYSTEMS AND METHODS TO TRACK THE EVOLUTION OF SINGLE CELLS GENENTECH, INC. (US) 2021-09-23 WO disclosed
EP-3700901-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF Genentech, Inc. (US) 2020-09-02 EP disclosed
CN-111265668-A Composition comprising a histamine release-promoting substance and an inhibitory compound 黄泳华 2020-06-12 CN disclosed
US-9452220-B2 Coupling compounds of NSAID anti-inflammatory and analgesic drugs and EGFR kinase inhibitors, synthesis methods and applications thereof GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-09-27 US disclosed
US-9452220-B2 Coupling compounds of NSAID anti-inflammatory and analgesic drugs and EGFR kinase inhibitors, synthesis methods and applications thereof GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-09-27 US disclosed
US-20160175453-A1 COUPLING COMPOUNDS OF NSAID ANTI-INFLAMMATORY AND ANALGESIC DRUGS AND EGFR KINASE INHIBITORS, SYNTHESIS METHODS AND APPLICATIONS THEREOF GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-06-23 US disclosed
US-20160175453-A1 COUPLING COMPOUNDS OF NSAID ANTI-INFLAMMATORY AND ANALGESIC DRUGS AND EGFR KINASE INHIBITORS, SYNTHESIS METHODS AND APPLICATIONS THEREOF GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-06-23 US disclosed
WO-2009070328-A1 MODULATORS OF THE EPIDERMAL GROWTH FACTOR RECEPTOR (EGFR) PATHWAY FOR USE IN THE TREATMENT OR PREVENTION OF SUBSTANCE ABUSE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-06-04 WO disclosed
US-5747498-A Alkynyl and azido-substituted 4-anilinoquinazolines PFIZER INC. (US) 1998-05-05 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-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF VHL, MDM2, CUL2 EGFR 2005/4885ERBB2 730/4885GAK 1549/4885
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof VHL, MDM2, CUL2 EGFR 2005/4885ERBB2 730/4885GAK 1549/4885
US-20160175453-A1 COUPLING COMPOUNDS OF NSAID ANTI-INFLAMMATORY AND ANALGESIC DRUGS AND EGFR KINASE INHIBITORS, SYNTHESIS METHODS AND APPLICATIONS THEREOF EGFR, CHUK, ERBB2 EGFR 1/4885ERBB2 3/4885GAK 490/4885

“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.