SCHEMBL16637106

SCHEMBL16637106

O=C(O)N1CCN(c2ncnc3c(F)c(Br)c(Cl)cc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KRAS P01116 10/20 0.51
EGFR P00533 1/20 0.51
HMOX2 P30519 1/20 0.51
CRYZ Q08257 1/20 0.51
VAT1 Q99536 1/20 0.51
RTN4 Q9NQC3 1/20 0.51
MAPT P10636 3/20 0.39
LMNA P02545 1/20 0.39
PRNP P04156 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
PPARG P37231 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NR2E3 Q9Y5X4 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
KIT P10721 2/20 0.38
AKT1 P31749 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL21839499 0.88 KRAS (0.43) KRASEGFRHMOX2CRYZVAT1
SCHEMBL16636828 0.88 KRAS (0.66) KRASEGFRHMOX2CRYZVAT1
SCHEMBL26967249 0.84 KRAS (0.47) KRASEGFRHMOX2CRYZVAT1
SCHEMBL29611722 0.84 KIT (0.50) KRASEGFRHMOX2CRYZVAT1
SCHEMBL16636962 0.84 KIT (0.50) KRASEGFRHMOX2CRYZVAT1
SCHEMBL16637205 0.84 ABL1 (0.39) KRASEGFRHMOX2CRYZVAT1
SCHEMBL19681369 0.83 ACHE (0.44) KRASEGFRHMOX2CRYZVAT1
SCHEMBL17030840 0.83 MAPT (0.57) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128592 0.82 KIT (0.42) KRASEGFRHMOX2CRYZVAT1
SCHEMBL19695793 0.81 HTT (0.49) KRASEGFRHMOX2CRYZVAT1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043441-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-02-08 US disclosed
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2024-01-23 US disclosed
US-20230303586-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-09-28 US disclosed
US-20230212183-A9 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-07-06 US disclosed
US-20210188869-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2021-06-24 US disclosed
US-10968214-B2 KRas G12C inhibitors ELI LILLY AND COMPANY (US) 2021-04-06 US disclosed
WO-2021051034-A1 RAS PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2021-03-18 WO disclosed
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2021-02-23 US disclosed
US-10829458-B2 Substituted quinazoline compounds and methods of use thereof ARAXES PHARMA LLC (US) 2020-11-10 US disclosed
US-20200115375-A1 KRAS G12C INHIBITORS ELI LILLY AND COMPANY 2020-04-16 US disclosed
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2019-08-06 US disclosed
US-10246424-B2 Substituted quinazoline compounds and methods of use thereof ARAXES PHARMA LLC (US) 2019-04-02 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
EP-3280708-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF Araxes Pharma LLC (US) 2018-02-14 EP disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
US-20160297774-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2016-10-13 US disclosed
WO-2016164675-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF ARAXES PHARMA LLC (US) 2016-10-13 WO disclosed
EP-3055290-A1 INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-08-17 EP disclosed
US-20150239900-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2015-08-27 US disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 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 (14 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-20200115375-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS KRAS 1/4885EGFR 57/4885HMOX2 3968/4885
US-20210188869-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 180/4885HMOX2 4456/4885
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 247/4885HMOX2 3757/4885
US-10246424-B2 Substituted quinazoline compounds and methods of use thereof KRAS, NRAS, HRAS KRAS 1/4885EGFR 210/4885HMOX2 4526/4885
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 262/4885HMOX2 4165/4885
US-20160297774-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF KRAS, NRAS, HRAS KRAS 1/4885EGFR 210/4885HMOX2 4526/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 262/4885HMOX2 4165/4885
US-10968214-B2 KRas G12C inhibitors KRAS, NRAS, HRAS KRAS 1/4885EGFR 57/4885HMOX2 3968/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 180/4885HMOX2 4456/4885
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 365/4885HMOX2 3796/4885
US-10829458-B2 Substituted quinazoline compounds and methods of use thereof KRAS, NRAS, HRAS KRAS 1/4885EGFR 210/4885HMOX2 4526/4885
US-20230212183-A9 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 180/4885HMOX2 4456/4885
US-20240043441-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 180/4885HMOX2 4456/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS KRAS 1/4885EGFR 180/4885HMOX2 4456/4885

“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.