SCHEMBL1680217

SCHEMBL1680217

CCOc1cc(F)cc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.50
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
SOD1 P00441 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KAT6A Q92794 1/20 0.39
LTA4H P09960 2/20 0.38
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
IDO1 P14902 1/20 0.36
MAPT P10636 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
SCHEMBL5671801 0.95 NQO1 (0.50) NQO1FGFR1FGFR2SOD1TDP1
SCHEMBL256791 0.86 NQO1 (0.42) NQO1FGFR1FGFR2TDP1TSHR
SCHEMBL12093390 0.86 ESR1 (0.50) NQO1FGFR1FGFR2KAT6AMAPT
SCHEMBL6832377 0.84 MAPT (0.41) NQO1FGFR1FGFR2KAT6AMAPT
SCHEMBL16184443 0.84 FGFR1 (0.41) NQO1FGFR1FGFR2SOD1TDP1
SCHEMBL16961122 0.84 FGFR1 (0.41) NQO1FGFR1FGFR2SOD1TDP1
SCHEMBL2395245 0.84 CA12 (0.48) NQO1FGFR1FGFR2SOD1KAT6A
SCHEMBL13361876 0.84 FGFR1 (0.41) NQO1FGFR1FGFR2SOD1TDP1
SCHEMBL12269073 0.84 FGFR1 (0.41) NQO1FGFR1FGFR2SOD1TDP1
SCHEMBL2225192 0.84 FGFR1 (0.41) NQO1FGFR1FGFR2SOD1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11377434-B2 Methods for preparing substituted chromanone derivatives HANGZHOU DUYI TECHNOLOGY CO. LTD. (CN) 2022-07-05 US disclosed
US-20220024890-A1 METHODS FOR PREPARING SUBSTITUTED CHROMANONE DERIVATIVES HANGZHOU DUYI TECHNOLOGY CO. LTD. (CN) 2022-01-27 US disclosed
EP-3666769-A1 NOVEL CASPASE INHIBITORS RIJKSUNIVERSITEIT GRONINGEN (NL) 2020-06-17 EP disclosed
CN-106573927-B Oxyclohepten-2-yl-pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use 豪夫迈·罗氏有限公司 2019-09-27 CN disclosed
CN-104640858-B Cyclic ether pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use 霍夫曼-拉罗奇有限公司 2018-11-06 CN disclosed
CN-108715590-A It can be used as the thiazole carboxamides and pyridinecarboxylic amine compounds of PIM kinase inhibitors 因赛特公司 2018-10-30 CN disclosed
CN-105051029-B Thiazolecarboxamide and picolinamide compounds useful as PIM kinase inhibitors 因赛特公司 2018-07-31 CN disclosed
US-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES GENENTECH, INC. (US) 2017-01-05 US disclosed
US-8574814-B2 Actinic ray-sensitive or radiation-sensitive resin composition, and actinic ray-sensitive or radiation-sensitive film and pattern forming method using the composition FUJIFILM CORPORATION (JP) 2013-11-05 US disclosed
US-8574814-B2 Actinic ray-sensitive or radiation-sensitive resin composition, and actinic ray-sensitive or radiation-sensitive film and pattern forming method using the composition FUJIFILM CORPORATION (JP) 2013-11-05 US disclosed
WO-2009062874-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS FXR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-05-22 WO disclosed
US-20090131482-A1 METHYL-BENZIMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2009-05-21 US disclosed
US-20080318922-A1 Bicyclic Pyrrole Derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-12-25 US disclosed
EP-1979344-A2 N-(2,3-DIFLUOROPHENYL)-2-[4-({7-METHOXY-5-[(2R)-PIPERIDIN.-2-YLMETHOXY]QUINAZOLIN-4-YL}AMINO)-1H-PYRAZOL-1-YL]ACETAMIDE AND N-(2,3-DIFLUOROPHENYL)-2-[4-({7-ETHOXY-5-[(2R)-PIPERIDIN.-2-YLMETHOXY]QUINAZOLIN-4-YL}AMINO)-1H-PYRAZOL-1-YL]ACETAMIDE FOR USE IN THE TREATMENT OF DISEASE AstraZeneca AB (SE) 2008-10-15 EP disclosed
US-20080194556-A1 Quinazolines and Their Use as Aurora Kinase Inhibitors ASTRAZENECA AB (SE) 2008-08-14 US disclosed
US-7342115-B2 Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology NEUROGEN CORPORATION (US) 2008-03-11 US disclosed
EP-1888572-A1 QUINAZOLINES AND THEIR USE AS AURORA KINASE INHIBITORS AstraZeneca AB (SE) 2008-02-20 EP disclosed
WO-2007125398-A2 : SULFONAMIDE COMPOUNDS AS ANTAGONISTS OF THE N-TYPE CALCIUM CHANNEL PFIZER JAPAN INC. (JP) 2007-11-08 WO disclosed
WO-2007083096-A2 N- (2, 3-DIFLUOROPHENYL) -2- [4- ( {7-METHOXY-5- [ (2R) -PIPERIDIN. -2-YLMETHOXY] QUINAZOLI N-4-YL}AMINO) -LH-PYRAZOL-1-YL] ACETAMIDE AND N- (2, 3 -D I FLUORO PHENYL) -2- [4- ( {7-ETHOXY-5- [ (2R) -PIPERIDIN. -2-YLMETHOXY] QUINAZOLIN ASTRAZENECA AB (SE) 2007-07-26 WO disclosed
WO-2006129064-A1 QUINAZOLINES AND THEIR USE AS AURORA KINASE INHIBITORS ASTRAZENECA AB (SE) 2006-12-07 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 (6 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-20080194556-A1 Quinazolines and Their Use as Aurora Kinase Inhibitors AURKA, AURKC, AURKB NQO1 1337/4885FGFR1 739/4885FGFR2 1374/4885
US-20080318922-A1 Bicyclic Pyrrole Derivatives DPP4, DPP7, DPP3 NQO1 1384/4885FGFR1 506/4885FGFR2 1284/4885
US-20170001990-A1 PIPERIDINE-DIONE DERIVATIVES DRD4, ADORA1, ADORA3 NQO1 876/4885FGFR1 2565/4885FGFR2 2789/4885
US-20220024890-A1 METHODS FOR PREPARING SUBSTITUTED CHROMANONE DERIVATIVES CBR3, CYP2F1, CBR1 NQO1 60/4885FGFR1 3592/4885FGFR2 4001/4885
US-20090131482-A1 METHYL-BENZIMIDAZOLE DERIVATIVES HDAC10, CYP3A4, ECI1 NQO1 2102/4885FGFR1 1324/4885FGFR2 1007/4885
US-11377434-B2 Methods for preparing substituted chromanone derivatives CYP2E1, CYP2F1, CBR1 NQO1 69/4885FGFR1 3465/4885FGFR2 4125/4885

“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.