SCHEMBL856477

SCHEMBL856477

Cc1cccc2cnc(Cl)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.39
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MGAM O43451 3/20 0.37
GAA P10253 3/20 0.37
SI P14410 3/20 0.37
MGAM2 Q2M2H8 3/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
ATM Q13315 1/20 0.37
CYP2A6 P11509 2/20 0.36
CYP1A2 P05177 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
RPS6KA5 O75582 1/20 0.36
ALDH1A1 P00352 2/20 0.35
AR P10275 1/20 0.35

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
Ethoxycarbonyl Group SCHEMBL28828682 0.82 DRD4 (0.34) EGFRDRD4DRD3L3MBTL1PDE3B
SCHEMBL8404376 0.79 CYP2A6 (0.39) PDE3BPDE3AATMCYP2A6CYP1A2
SCHEMBL2917596 0.79 NOS1 (0.39) EGFRL3MBTL1GAACYP2A6CYP1A2
SCHEMBL1634276 0.76 METAP2 (0.48) GAACYP1A2ADRA1AALDH1A1
SCHEMBL2916502 0.76 FGFR1 (0.50) EGFRALDH1A1
SCHEMBL23003201 0.76 EGFR (0.38) EGFRL3MBTL1GAARPS6KA5ALDH1A1
SCHEMBL27351676 0.76 KDM4E (0.35) EGFRCYP2A6CYP1A2RPS6KA5ALDH1A1
SCHEMBL31114211 0.76 BACE1 (0.46) EGFRCYP1A2RPS6KA5ALDH1A1AR
SCHEMBL19466048 0.76 PARP1 (0.37) L3MBTL1GAAPDE3BPDE3AATM
SCHEMBL559708 0.76 BACE1 (0.46) EGFRCYP1A2RPS6KA5ALDH1A1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105283454-B Quinazoline and azepine quinazoline as RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/MTOR access double inhibitor ASANA BIOSCIENCES, LLC (US) 2019-10-29 CN disclosed
CN-108699032-A Polycyclic T L R7/8 antagonists and their use in treating immune disorders 默克专利有限公司 2018-10-23 CN disclosed
CN-105473574-B Somatostatin receptor subtype 4(SSTR4) agonists 森特克森治疗公司 2018-02-13 CN disclosed
CN-105025899-B Having a2AHeterobicyclically substituted- [1,2,4 ] antagonists]Triazolo [1,5-c]Quinazoline-5-amine compounds 默沙东公司 2017-08-18 CN disclosed
CN-105473574-A Novel somatostatin receptor subtype 4(SSTR4) agonists BOEHRINGER INGELHEIM INT 2016-04-06 CN disclosed
CN-105452238-A Bicyclic derivatives containing a pyrimidine ring and process for preparing the same YUHAN CORP 2016-03-30 CN disclosed
CN-105283454-A Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/MTOR pathways ASANA BIOSCIENCES LLC 2016-01-27 CN disclosed
CN-105025899-A Having a2AHeterobicyclically substituted- [1 ] with antagonist properties MERCK SHARP & DOHME 2015-11-04 CN disclosed
CN-103724282-B Synthesis method of quinazoline derivatives as pharmaceutical intermediate YU HAIBO 2015-07-08 CN disclosed
CN-104610169-A Quinazoline-containing thioether substituted pentadiene ketone derivatives, and preparation method and application thereof UNIV GUIZHOU 2015-05-13 CN disclosed
EP-2432779-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES Exelixis, Inc. (US) 2012-03-28 EP disclosed
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
WO-2010135524-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES EXELIXIS, INC. (US) 2010-11-25 WO disclosed
EP-2226315-A1 2-AMINOQUINAZOLINE DERIVATIVE Carna Biosciences Inc. (JP) 2010-09-08 EP disclosed
EP-2226315-A1 2-AMINOQUINAZOLINE DERIVATIVE Carna Biosciences Inc. (JP) 2010-09-08 EP disclosed
WO-2009084695-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2009-07-09 WO disclosed
CN-1033380-A Compound SMITHKLINE BECKMAN INTERCREDIT (NL) 1989-06-14 CN 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 (1 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-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE DSTYK, ABL1, EEF2K EGFR 479/4885DRD4 3928/4885DRD3 3307/4885

“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.