SCHEMBL16637341

SCHEMBL16637341

O=C(O)N1CCN(c2cnnc3cc(Br)c(Cl)cc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.41
AKT1 P31749 1/20 0.40
ABL1 P00519 4/20 0.37
BCR P11274 4/20 0.37
CNR1 P21554 3/20 0.37
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 3/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NCF1 P14598 1/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CA P42336 2/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CG P48736 2/20 0.33
CLK1 P49759 1/20 0.33
IDE P14735 1/20 0.33
CCR5 P51681 1/20 0.33
USP2 O75604 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL29765713 0.84 CNR1 (0.44) PDGFRBCNR1
SCHEMBL16637332 0.84 CNR1 (0.44) PDGFRBCNR1
SCHEMBL21839989 0.74 PDGFRB (0.49) PDGFRB
SCHEMBL22631353 0.74 ABL1 (0.45) PDGFRBABL1BCRALDH1A1SMN1; SMN2
SCHEMBL16637611 0.72 KRAS (0.58)
SCHEMBL22631427 0.72 KRAS (0.46) ABL1BCRSMN1; SMN2
SCHEMBL22631320 0.72 ABL1 (0.40) PDGFRBABL1BCR
SCHEMBL16637485 0.71 KDR (0.38) ALDH1A1MAPK1USP2TP53HPGD
SCHEMBL22631398 0.70 KRAS (0.49) ABL1BCRALDH1A1MAPK1SMN1; SMN2
SCHEMBL22631444 0.70 KRAS (0.48) PDGFRBABL1BCRPIK3CA

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 16 patents. 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-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2021-02-23 US disclosed
CN-106488910-B Inhibitors of KRAS G12C 亚瑞克西斯制药公司 2020-07-31 CN disclosed
EP-3636639-A1 INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2020-04-15 EP disclosed
US-20200102321-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2020-04-02 US disclosed
EP-3055290-B1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2019-10-02 EP disclosed
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2019-08-06 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-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 (10 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 PDGFRB 1746/4885AKT1 39/4885ABL1 216/4885
US-10927125-B2 Substituted cinnolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PDGFRB 2226/4885AKT1 33/4885ABL1 256/4885
US-11878985-B2 Substituted quinazolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PDGFRB 1938/4885AKT1 45/4885ABL1 82/4885
US-20200102321-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1938/4885AKT1 45/4885ABL1 82/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1938/4885AKT1 45/4885ABL1 82/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1746/4885AKT1 39/4885ABL1 216/4885
US-10370386-B2 Substituted quinolines as inhibitors of KRAS G12C KRAS, NRAS, HRAS PDGFRB 2158/4885AKT1 53/4885ABL1 95/4885
US-20230212183-A9 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1746/4885AKT1 39/4885ABL1 216/4885
US-20240043441-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1746/4885AKT1 39/4885ABL1 216/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS PDGFRB 1746/4885AKT1 39/4885ABL1 216/4885

“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.