SCHEMBL16637571

SCHEMBL16637571

C=CC(=O)NC(=O)C1CN(c2nccc3cc(Cl)ccc23)CCN1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 1/20 0.38
ADRB2 P07550 1/20 0.35
NCF1 P14598 1/20 0.35
HTR6 P50406 2/20 0.34
HTR1A P08908 2/20 0.34
HTR1D P28221 2/20 0.34
HTR1B P28222 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTR2C P28335 1/20 0.33
NAMPT P43490 2/20 0.33
CYP3A4 P08684 1/20 0.33
CCR4 P51679 3/20 0.33
DPP4 P27487 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK7 P50613 1/20 0.33
CCNH P51946 1/20 0.33
MNAT1 P51948 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
KRAS P01116 1/20 0.33

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
SCHEMBL16637446 0.82 EIF2AK4 (0.41) PRKD1ADRB2NCF1HTR1AHTR1D
SCHEMBL16637740 0.73 KRAS (0.40) KRAS
SCHEMBL16636885 0.70 KRAS (0.39) HTR1AHTR1DHTR1BALDH1A1KRAS
SCHEMBL16636875 0.70 KRAS (0.40) HTR1AHTR1DHTR1BALDH1A1DPP4
SCHEMBL29765657 0.70 KRAS (0.40) HTR1AHTR1DHTR1BALDH1A1DPP4
SCHEMBL3683092 0.70 HTR2C (0.64) PRKD1ADRB2NCF1HTR6HTR1A
Hydrochloric Acid SCHEMBL31587078 0.69 HTR2C (0.62) PRKD1ADRB2NCF1HTR6HTR1A
SCHEMBL17844907 0.67 HTR2C (0.53) PRKD1HTR2CDPP4MALT1
SCHEMBL24704356 0.66 GRM4 (0.44) DPP4MALT1
SCHEMBL28729054 0.66 GRM4 (0.44) DPP4MALT1

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-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2025-02-25 US disclosed
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2024-10-24 US disclosed
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-20220242875-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2022-08-04 US disclosed
US-20210188869-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2021-06-24 US disclosed
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2021-02-23 US disclosed
EP-3193851-B1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2020-10-21 EP disclosed
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2019-08-06 US disclosed
US-10111874-B2 Combination therapies for treatment of cancer ARAXES PHARMA LLC (US) 2018-10-30 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
EP-3193851-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER Araxes Pharma LLC (US) 2017-07-26 EP disclosed
EP-3055290-A1 INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-08-17 EP disclosed
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC 2016-06-16 US disclosed
WO-2016044772-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2016-03-24 WO 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-20210188869-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PRKD1 526/4885ADRB2 2034/4885NCF1 1450/4885
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PRKD1 828/4885ADRB2 3257/4885NCF1 2865/4885
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PRKD1 699/4885ADRB2 1760/4885NCF1 2538/4885
US-20240352028-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 699/4885ADRB2 1760/4885NCF1 2538/4885
US-10111874-B2 Combination therapies for treatment of cancer KRAS, TP53, HRAS PRKD1 1268/4885ADRB2 4602/4885NCF1 947/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 699/4885ADRB2 1760/4885NCF1 2538/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PRKD1 847/4885ADRB2 1487/4885NCF1 2893/4885
US-20230212183-A9 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-20240043441-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-20220242875-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PRKD1 720/4885ADRB2 2352/4885NCF1 2471/4885
US-20160166571-A1 COMBINATION THERAPIES FOR TREATMENT OF CANCER KRAS, TP53, HRAS PRKD1 1268/4885ADRB2 4602/4885NCF1 947/4885

“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.