SCHEMBL2585583

SCHEMBL2585583

CCn1cc(-c2cnc3ccc(N(CCNC(C)C)c4cc(OC)cc(OC)c4)cc3n2)cn1

nearest known ligand 0.98

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 20/20 0.98
FGFR2 P21802 17/20 0.98
FGFR3 P22607 17/20 0.98
FGFR4 P22455 16/20 0.98
KDR P35968 15/20 0.98
ADORA3 P0DMS8 1/20 0.81
CHRM1 P11229 1/20 0.81
ADRA2C P18825 1/20 0.81
SLC6A2 P23975 1/20 0.81
SLC6A4 P31645 1/20 0.81
DRD3 P35462 1/20 0.81
OPRD1 P41143 1/20 0.81
ETV6 P41212 1/20 0.81
HTR2B P41595 1/20 0.81
SLC6A3 Q01959 1/20 0.81
PDE4D Q08499 1/20 0.81
FLT3 P36888 4/20 0.79
HDAC1 Q13547 2/20 0.74

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
Hydrochloric Acid SCHEMBL27218142 0.99 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL18176515 0.93 FGFR1 (0.86) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL18176339 0.93 FGFR1 (0.86) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL2583984 0.91 FGFR1 (0.84) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL12178579 0.91 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
Erdafitinib SCHEMBL2583760 0.90 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
Erdafitinib SCHEMBL29359988 0.90 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL12178260 0.90 FGFR1 (0.86) FGFR1FGFR2FGFR3FGFR4KDR
Erdafitinib SCHEMBL17979118 0.89 FGFR3 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL12179221 0.89 FGFR1 (0.98) FGFR1FGFR2FGFR3FGFR4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220135544-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2022-05-05 US disclosed
US-20220135544-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2022-05-05 US disclosed
CN-106459010-B Quinoxaline derivatives as FGFR kinase modulators 阿斯特克斯治疗有限公司 2020-11-03 CN disclosed
US-20200131153-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2020-04-30 US disclosed
US-20200131153-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2020-04-30 US disclosed
US-10421747-B2 Quinoxaline derivatives useful as FGFR kinase modulators ASTEX THERAPEUTICS LTD (GB) 2019-09-24 US disclosed
EP-3178818-B1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2019-05-22 EP disclosed
EP-3122742-B1 QUINOXALINE DERIVATIVES USEFUL AS FGFR KINASE MODULATORS ASTEX THERAPEUTICS LTD (GB) 2018-09-19 EP disclosed
US-20180186775-A1 QUINOXALINE DERIVATIVES USEFUL AS FGFR KINASE MODULATORS ASTEX THERAPEUTICS LTD (GB) 2018-07-05 US disclosed
US-20180127397-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2018-05-10 US disclosed
US-20150105368-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2015-04-16 US disclosed
US-8895601-B2 Pyrazolyl quinoxaline kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2014-11-25 US disclosed
US-8895601-B2 Pyrazolyl quinoxaline kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2014-11-25 US disclosed
US-8895601-B2 Pyrazolyl quinoxaline kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2014-11-25 US disclosed
US-20130072457-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2013-03-21 US disclosed
US-20130072457-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2013-03-21 US disclosed
US-20130072457-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2013-03-21 US disclosed
EP-2563775-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS Astex Therapeutics Limited (GB) 2013-03-06 EP disclosed
WO-2011135376-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2011-11-03 WO disclosed
WO-2011135376-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2011-11-03 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 (7 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-20200131153-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS PDXK, DCK, PDPK1 FGFR1 1681/4885FGFR2 3362/4885FGFR3 2685/4885
US-20130072457-A1 PYRAZOLYL QUINAZOLINE KINASE INHIBITORS MAP3K5, MAP3K1, MAP4K2 FGFR1 1333/4885FGFR2 2509/4885FGFR3 2031/4885
US-20150105368-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS PDXK, DCK, PDPK1 FGFR1 1681/4885FGFR2 3362/4885FGFR3 2685/4885
US-20180186775-A1 QUINOXALINE DERIVATIVES USEFUL AS FGFR KINASE MODULATORS FGFR1, FGFR3, FGFR4 FGFR1 1/4885FGFR2 4/4885FGFR3 2/4885
US-20180127397-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS PDXK, DCK, PDPK1 FGFR1 1681/4885FGFR2 3362/4885FGFR3 2685/4885
US-10421747-B2 Quinoxaline derivatives useful as FGFR kinase modulators FGFR1, FGFR3, FGFR4 FGFR1 1/4885FGFR2 4/4885FGFR3 2/4885
US-20220135544-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS PDXK, DCK, PDPK1 FGFR1 1681/4885FGFR2 3362/4885FGFR3 2685/4885

“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.